datasetS2/0000755000175000017500000000000010747436415012305 5ustar oliveroliverdatasetS2/strict_no_o2/0000755000175000017500000000000010747436025014706 5ustar oliveroliverdatasetS2/strict_no_o2/reaction_list.txt0000644000175000017500000007214710747436025020321 0ustar oliveroliverR00004 R00005 R00006 R00008 R00009 R00010 R00011 R00012 R00013 R00014 R00015 R00016 R00018 R00022 R00023 R00024 R00025 R00026 R00027 R00028 R00031 R00032 R00033 R00035 R00036 R00038 R00039 R00040 R00042 R00043 R00044 R00045 R00047 R00048 R00049 R00053 R00054 R00055 R00058 R00059 R00062 R00063 R00064 R00066 R00068 R00069 R00070 R00072 R00073 R00074 R00078 R00080 R00083 R00084 R00085 R00086 R00087 R00088 R00089 R00090 R00091 R00093 R00094 R00095 R00099 R00104 R00105 R00112 R00113 R00114 R00115 R00118 R00120 R00122 R00123 R00124 R00125 R00126 R00127 R00128 R00130 R00131 R00132 R00136 R00138 R00139 R00140 R00143 R00149 R00150 R00155 R00156 R00157 R00158 R00159 R00160 R00161 R00173 R00174 R00178 R00181 R00182 R00183 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R02269 R02270 R02271 R02272 R02273 R02274 R02276 R02278 R02279 R02280 R02282 R02283 R02284 R02285 R02286 R02287 R02291 R02292 R02293 R02296 R02297 R02299 R02303 R02305 R02306 R02307 R02310 R02311 R02313 R02315 R02317 R02318 R02325 R02326 R02327 R02328 R02329 R02330 R02331 R02332 R02338 R02340 R02341 R02342 R02343 R02344 R02345 R02347 R02349 R02350 R02351 R02352 R02353 R02354 R02355 R02356 R02358 R02359 R02363 R02365 R02367 R02368 R02369 R02370 R02371 R02372 R02373 R02375 R02376 R02378 R02380 R02381 R02382 R02383 R02385 R02387 R02388 R02389 R02391 R02393 R02394 R02395 R02396 R02397 R02398 R02401 R02402 R02404 R02405 R02406 R02407 R02408 R02410 R02411 R02412 R02413 R02415 R02416 R02417 R02419 R02422 R02423 R02424 R02425 R02426 R02427 R02428 R02429 R02430 R02431 R02433 R02434 R02436 R02437 R02438 R02439 R02441 R02442 R02443 R02444 R02445 R02446 R02447 R02449 R02452 R02453 R02454 R02455 R02456 R02457 R02458 R02461 R02462 R02463 R02464 R02466 R02467 R02468 R02469 R02470 R02471 R02472 R02473 R02474 R02476 R02477 R02478 R02481 R02482 R02484 R02485 R02486 R02487 R02489 R02490 R02491 R02493 R02494 R02499 R02500 R02501 R02502 R02504 R02505 R02506 R02508 R02509 R02512 R02513 R02514 R02515 R02516 R02517 R02518 R02519 R02520 R02521 R02522 R02525 R02526 R02527 R02529 R02530 R02531 R02532 R02535 R02536 R02539 R02540 R02544 R02546 R02547 R02548 R02549 R02551 R02552 R02553 R02554 R02555 R02556 R02557 R02558 R02559 R02560 R02561 R02562 R02563 R02564 R02568 R02571 R02572 R02574 R02575 R02576 R02577 R02580 R02581 R02583 R02587 R02589 R02590 R02591 R02593 R02594 R02595 R02601 R02602 R02603 R02604 R02606 R02607 R02609 R02610 R02613 R02615 R02618 R02619 R02632 R02633 R02634 R02636 R02637 R02639 R02640 R02644 R02648 R02649 R02656 R02657 R02658 R02659 R02660 R02661 R02664 R02665 R02666 R02668 R02669 R02672 R02673 R02677 R02678 R02679 R02680 R02683 R02684 R02695 R02697 R02698 R02699 R02700 R02701 R02702 R02705 R02706 R02707 R02708 R02709 R02711 R02712 R02714 R02715 R02719 R02720 R02722 R02727 R02728 R02729 R02730 R02731 R02732 R02733 R02734 R02735 R02736 R02737 R02739 R02740 R02741 R02742 R02743 R02748 R02749 R02750 R02752 R02754 R02755 R02763 R02764 R02765 R02771 R02772 R02773 R02774 R02776 R02777 R02778 R02781 R02782 R02783 R02785 R02786 R02788 R02792 R02793 R02794 R02797 R02798 R02799 R02800 R02801 R02805 R02807 R02810 R02813 R02815 R02817 R02821 R02825 R02830 R02831 R02832 R02834 R02836 R02837 R02839 R02840 R02841 R02842 R02848 R02849 R02850 R02852 R02853 R02855 R02862 R02863 R02864 R02865 R02866 R02867 R02868 R02872 R02874 R02875 R02877 R02878 R02892 R02893 R02894 R02896 R02897 R02898 R02899 R02901 R02902 R02906 R02907 R02908 R02909 R02911 R02914 R02915 R02919 R02921 R02922 R02923 R02925 R02926 R02927 R02928 R02929 R02930 R02932 R02933 R02935 R02936 R02937 R02938 R02941 R02942 R02943 R02944 R02945 R02946 R02947 R02948 R02949 R02951 R02952 R02954 R02955 R02956 R02957 R02963 R02967 R02968 R02969 R02970 R02971 R02972 R02973 R02974 R02975 R02976 R02978 R02979 R02983 R02984 R02985 R02986 R02988 R02989 R02990 R02991 R02992 R02994 R02995 R02997 R02998 R03001 R03004 R03005 R03006 R03008 R03009 R03012 R03013 R03014 R03018 R03021 R03022 R03023 R03024 R03025 R03026 R03027 R03028 R03030 R03031 R03032 R03033 R03034 R03035 R03036 R03037 R03040 R03043 R03044 R03045 R03046 R03049 R03050 R03051 R03052 R03053 R03054 R03055 R03056 R03057 R03058 R03059 R03062 R03063 R03064 R03065 R03066 R03067 R03069 R03070 R03073 R03075 R03077 R03080 R03081 R03083 R03084 R03088 R03089 R03090 R03091 R03092 R03093 R03094 R03095 R03096 R03097 R03098 R03099 R03102 R03103 R03104 R03105 R03106 R03114 R03119 R03123 R03124 R03125 R03126 R03127 R03128 R03131 R03133 R03134 R03138 R03139 R03140 R03148 R03153 R03154 R03155 R03157 R03158 R03161 R03163 R03165 R03166 R03168 R03169 R03170 R03172 R03176 R03177 R03178 R03180 R03181 R03182 R03183 R03184 R03186 R03187 R03188 R03189 R03192 R03193 R03197 R03198 R03199 R03200 R03202 R03204 R03207 R03208 R03209 R03210 R03211 R03213 R03216 R03217 R03220 R03222 R03225 R03226 R03227 R03228 R03230 R03231 R03236 R03237 R03238 R03239 R03240 R03241 R03243 R03244 R03245 R03246 R03247 R03248 R03249 R03250 R03251 R03252 R03253 R03254 R03256 R03260 R03261 R03264 R03265 R03266 R03267 R03269 R03275 R03276 R03277 R03279 R03281 R03283 R03284 R03286 R03288 R03289 R03291 R03293 R03294 R03296 R03297 R03298 R03300 R03302 R03303 R03306 R03307 R03308 R03310 R03311 R03313 R03314 R03315 R03317 R03318 R03319 R03321 R03323 R03324 R03325 R03327 R03328 R03329 R03330 R03331 R03333 R03336 R03337 R03339 R03341 R03342 R03344 R03345 R03346 R03347 R03349 R03350 R03351 R03352 R03353 R03357 R03358 R03359 R03365 R03367 R03369 R03371 R03372 R03374 R03375 R03378 R03380 R03383 R03384 R03385 R03386 R03387 R03388 R03390 R03391 R03392 R03393 R03394 R03395 R03396 R03397 R03398 R03399 R03401 R03402 R03404 R03405 R03406 R03407 R03408 R03409 R03418 R03421 R03427 R03428 R03429 R03430 R03431 R03433 R03434 R03439 R03440 R03443 R03444 R03445 R03448 R03452 R03457 R03458 R03459 R03460 R03461 R03462 R03463 R03465 R03466 R03470 R03471 R03478 R03479 R03493 R03495 R03497 R03498 R03503 R03504 R03507 R03508 R03509 R03511 R03512 R03517 R03518 R03520 R03521 R03524 R03530 R03531 R03534 R03535 R03537 R03538 R03540 R03541 R03542 R03543 R03545 R03546 R03547 R03548 R03549 R03550 R03551 R03555 R03556 R03558 R03559 R03563 R03564 R03565 R03567 R03572 R03573 R03574 R03576 R03579 R03581 R03582 R03583 R03586 R03588 R03589 R03590 R03591 R03592 R03593 R03595 R03601 R03604 R03605 R03607 R03610 R03612 R03614 R03616 R03620 R03621 R03622 R03624 R03625 R03626 R03627 R03628 R03630 R03631 R03634 R03635 R03637 R03638 R03639 R03640 R03641 R03642 R03667 R03668 R03671 R03672 R03673 R03674 R03675 R03677 R03685 R03686 R03688 R03691 R03692 R03693 R03694 R03695 R03696 R03700 R03702 R03703 R03709 R03710 R03712 R03716 R03718 R03719 R03720 R03723 R03727 R03728 R03732 R03733 R03735 R03736 R03737 R03738 R03741 R03745 R03747 R03751 R03753 R03758 R03759 R03761 R03762 R03766 R03770 R03772 R03774 R03775 R03776 R03777 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R04099 R04100 R04103 R04105 R04106 R04108 R04112 R04113 R04115 R04117 R04119 R04127 R04130 R04131 R04132 R04133 R04134 R04135 R04136 R04137 R04139 R04140 R04141 R04142 R04143 R04144 R04147 R04150 R04151 R04152 R04154 R04158 R04161 R04163 R04164 R04165 R04166 R04167 R04170 R04171 R04172 R04173 R04174 R04175 R04177 R04179 R04180 R04185 R04186 R04187 R04188 R04189 R04198 R04199 R04200 R04201 R04202 R04203 R04204 R04205 R04206 R04208 R04209 R04210 R04211 R04213 R04214 R04215 R04217 R04218 R04221 R04222 R04223 R04224 R04228 R04229 R04230 R04231 R04233 R04234 R04235 R04236 R04246 R04247 R04248 R04256 R04258 R04259 R04260 R04263 R04264 R04266 R04269 R04270 R04271 R04277 R04278 R04279 R04280 R04285 R04286 R04292 R04293 R04296 R04297 R04300 R04305 R04306 R04307 R04309 R04317 R04323 R04325 R04328 R04329 R04330 R04333 R04334 R04335 R04336 R04338 R04339 R04340 R04342 R04344 R04345 R04346 R04347 R04349 R04350 R04351 R04352 R04353 R04354 R04356 R04357 R04359 R04364 R04365 R04367 R04370 R04371 R04372 R04373 R04374 R04376 R04378 R04379 R04380 R04382 R04383 R04387 R04388 R04391 R04397 R04399 R04400 R04405 R04412 R04417 R04418 R04420 R04424 R04425 R04426 R04435 R04436 R04438 R04439 R04441 R04443 R04444 R04445 R04446 R04447 R04448 R04451 R04453 R04455 R04457 R04460 R04463 R04464 R04467 R04475 R04476 R04478 R04479 R04481 R04482 R04483 R04486 R04487 R04488 R04489 R04490 R04498 R04501 R04506 R04507 R04509 R04510 R04512 R04515 R04517 R04518 R04520 R04522 R04523 R04525 R04526 R04527 R04529 R04531 R04532 R04538 R04540 R04541 R04547 R04549 R04552 R04556 R04557 R04558 R04559 R04560 R04565 R04570 R04572 R04573 R04576 R04577 R04579 R04580 R04587 R04591 R04592 R04593 R04594 R04597 R04602 R04605 R04606 R04608 R04609 R04617 R04618 R04619 R04620 R04621 R04623 R04638 R04639 R04640 R04641 R04657 R04658 R04666 R04671 R04672 R04673 R04674 R04675 R04678 R04680 R04681 R04682 R04683 R04686 R04687 R04688 R04690 R04691 R04694 R04696 R04697 R04699 R04702 R04708 R04709 R04716 R04723 R04728 R04731 R04732 R04734 R04736 R04738 R04740 R04742 R04744 R04746 R04747 R04749 R04751 R04753 R04754 R04756 R04757 R04758 R04770 R04772 R04776 R04777 R04779 R04780 R04781 R04783 R04784 R04785 R04786 R04787 R04789 R04792 R04793 R04804 R04806 R04807 R04809 R04811 R04813 R04817 R04818 R04819 R04823 R04824 R04825 R04826 R04828 R04829 R04830 R04831 R04832 R04833 R04834 R04835 R04836 R04837 R04838 R04839 R04840 R04842 R04843 R04844 R04845 R04846 R04847 R04849 R04850 R04851 R04853 R04854 R04855 R04857 R04862 R04868 R04870 R04872 R04874 R04875 R04882 R04883 R04884 R04888 R04889 R04890 R04891 R04892 R04893 R04894 R04895 R04900 R04901 R04902 R04903 R04907 R04908 R04909 R04911 R04914 R04915 R04916 R04917 R04918 R04929 R04930 R04936 R04941 R04942 R04945 R04946 R04972 R04975 R04979 R04982 R04986 R04998 R04999 R05027 R05028 R05030 R05032 R05033 R05038 R05039 R05043 R05046 R05048 R05049 R05050 R05052 R05053 R05055 R05056 R05057 R05058 R05062 R05064 R05066 R05068 R05069 R05070 R05071 R05074 R05076 R05078 R05083 R05085 R05086 R05087 R05092 R05097 R05099 R05100 R05103 R05104 R05120 R05121 R05124 R05125 R05128 R05130 R05133 R05134 R05135 R05137 R05138 R05141 R05142 R05147 R05148 R05150 R05153 R05154 R05155 R05156 R05157 R05158 R05160 R05165 R05166 R05168 R05169 R05170 R05171 R05172 R05174 R05176 R05177 R05198 R05200 R05202 R05207 R05208 R05217 R05221 R05222 R05224 R05225 R05226 R05228 R05229 R05230 R05231 R05233 R05234 R05236 R05237 R05238 R05239 R05240 R05244 R05245 R05246 R05248 R05251 R05256 R05257 R05259 R05261 R05262 R05263 R05264 R05266 R05267 R05268 R05269 R05271 R05272 R05274 R05275 R05276 R05277 R05278 R05279 R05280 R05283 R05284 R05285 R05287 R05288 R05289 R05290 R05291 R05294 R05295 R05296 R05297 R05298 R05299 R05300 R05301 R05305 R05307 R05308 R05310 R05311 R05312 R05313 R05315 R05317 R05319 R05320 R05321 R05322 R05326 R05328 R05330 R05331 R05332 R05334 R05336 R05337 R05338 R05339 R05341 R05347 R05348 R05349 R05350 R05351 R05353 R05354 R05356 R05357 R05358 R05359 R05360 R05361 R05362 R05363 R05364 R05365 R05367 R05368 R05369 R05370 R05371 R05372 R05373 R05374 R05375 R05376 R05377 R05378 R05379 R05380 R05381 R05382 R05383 R05384 R05385 R05386 R05387 R05388 R05389 R05390 R05391 R05392 R05393 R05394 R05395 R05396 R05397 R05399 R05400 R05401 R05402 R05403 R05404 R05405 R05406 R05407 R05408 R05409 R05410 R05411 R05412 R05413 R05414 R05415 R05417 R05418 R05420 R05421 R05423 R05424 R05425 R05427 R05428 R05429 R05434 R05435 R05436 R05439 R05440 R05441 R05442 R05443 R05444 R05445 R05446 R05447 R05448 R05449 R05450 R05451 R05452 R05455 R05456 R05457 R05465 R05466 R05467 R05468 R05469 R05475 R05477 R05478 R05483 R05484 R05485 R05486 R05487 R05493 R05495 R05498 R05499 R05500 R05501 R05502 R05503 R05504 R05506 R05507 R05508 R05509 R05510 R05511 R05513 R05515 R05516 R05517 R05519 R05527 R05530 R05531 R05533 R05534 R05536 R05538 R05540 R05543 R05544 R05546 R05548 R05549 R05551 R05552 R05553 R05554 R05555 R05558 R05559 R05560 R05561 R05562 R05563 R05564 R05565 R05566 R05567 R05568 R05569 R05571 R05572 R05573 R05574 R05575 R05576 R05581 R05582 R05585 R05586 R05587 R05588 R05590 R05591 R05592 R05593 R05594 R05595 R05596 R05597 R05598 R05599 R05600 R05601 R05602 R05603 R05604 R05605 R05606 R05607 R05608 R05609 R05610 R05612 R05613 R05615 R05616 R05618 R05620 R05621 R05622 R05623 R05626 R05627 R05628 R05629 R05630 R05632 R05633 R05634 R05636 R05637 R05639 R05640 R05641 R05642 R05643 R05644 R05645 R05646 R05647 R05648 R05649 R05650 R05651 R05652 R05653 R05654 R05655 R05656 R05658 R05659 R05660 R05661 R05662 R05663 R05664 R05665 R05668 R05672 R05677 R05678 R05679 R05680 R05681 R05683 R05684 R05685 R05686 R05687 R05688 R05689 R05690 R05691 R05692 R05693 R05694 R05696 R05698 R05699 R05700 R05701 R05702 R05703 R05705 R05706 R05707 R05713 R05714 R05715 R05716 R05717 R05718 R05719 R05720 R05722 R05723 R05724 R05725 R05727 R05728 R05729 R05730 R05731 R05732 R05733 R05735 R05736 R05737 R05738 R05746 R05749 R05750 R05758 R05761 R05762 R05765 R05766 R05767 R05768 R05769 R05771 R05772 R05773 R05774 R05775 R05778 R05779 R05781 R05783 R05784 R05789 R05790 R05791 R05799 R05800 R05801 R05804 R05805 R05812 R05814 R05815 R05823 R05824 R05825 R05826 R05827 R05828 R05830 R05831 R05832 R05833 R05835 R05836 R05838 R05839 R05841 R05842 R05843 R05844 R05845 R05847 R05848 R05850 R05855 R05856 R05857 R05858 R05861 R05862 R05863 R05864 R05865 R05866 R05870 R05874 R05876 R05877 R05878 R05879 R05880 R05882 R05884 R05885 R06047 R06048 R06117 R06119 R06120 R06126 R06146 R06154 R06166 R06171 R06180 R06223 R06254 R06255 R06256 R06257 R06265 R06266 R06267 R06269 R06270 R06271 R06272 R06284 R06286 R06291 R06292 R06294 R06295 R06296 R06298 R06299 R06300 R06301 R06302 R06303 R06304 R06305 R06307 R06308 R06309 R06310 R06311 R06312 R06322 R06323 R06335 R06336 R06337 R06338 R06366 R06369 R06371 R06380 R06381 R06398 R06406 R06407 R06408 R06411 R06412 R06413 R06414 R06415 R06418 R06422 R06423 R06424 R06426 R06428 R06429 R06430 R06431 R06432 R06433 R06434 R06435 R06436 R06437 R06439 R06440 R06447 R06450 R06451 R06452 R06455 R06457 R06460 R06461 R06464 R06466 R06469 R06471 R06472 R06473 R06474 R06475 R06484 R06485 R06486 R06487 R06488 R06489 R06490 R06491 R06492 R06493 R06494 R06495 R06496 R06497 R06498 R06499 R06500 R06501 R06502 R06506 R06510 R06511 R06512 R06513 R06514 R06520 R06521 R06523 R06525 R06529 R06530 R06532 R06533 R06534 R06535 R06536 R06537 R06538 R06539 R06540 R06544 R06545 R06546 R06551 R06556 R06557 R06558 R06559 R06560 R06561 R06562 R06563 R06569 R06570 R06571 R06572 R06573 R06582 R06583 R06589 R06590 R06591 R06592 R06593 R06594 R06595 R06601 R06602 R06603 R06606 R06607 R06610 R06611 R06613 R06615 R06622 R06624 R06626 R06628 R06629 R06631 R06633 R06634 R06649 R06659 R06660 R06662 R06664 R06665 R06666 R06667 R06668 R06675 R06676 R06680 R06681 R06684 R06686 R06715 R06716 R06717 R06718 R06719 R06720 R06728 R06729 R06730 R06734 R06740 R06757 R06758 R06769 R06770 R06772 R06773 R06777 R06778 R06782 R06783 R06784 R06785 R06786 R06787 R06788 R06789 R06792 R06793 R06795 R06796 R06797 R06799 R06800 R06801 R06802 R06803 R06804 R06805 R06806 R06808 R06809 R06810 R06811 R06812 R06813 R06814 R06817 R06818 R06819 R06820 R06821 R06826 R06827 R06828 R06829 R06830 R06831 R06832 R06833 R06834 R06835 R06836 R06838 R06839 R06840 R06842 R06843 R06844 R06845 R06846 R06847 R06848 R06851 R06856 R06857 R06860 R06866 R06869 R06870 R06871 R06883 R06884 R06885 R06886 R06887 R06888 R06890 R06891 R06892 R06893 R06894 R06896 R06897 R06903 R06904 R06905 R06906 R06907 R06908 R06909 R06910 R06911 R06912 R06913 R06914 R06915 R06916 R06917 R06918 R06919 R06921 R06922 R06923 R06924 R06925 R06926 R06927 R06928 R06930 R06931 R06932 R06933 R06934 R06935 R06936 R06937 R06939 R06940 R06941 R06942 R06943 R06944 R06945 R06946 R06947 R06948 R06949 R06950 R06951 R06952 R06953 R06954 R06957 R06960 R06962 R06963 R06965 R06966 R06967 R06968 R06969 R06970 R06971 R06972 R06973 R06974 R06975 R06976 R06977 R06978 R06979 R06980 R06982 R06983 R06985 R06987 R06988 R06989 R06990 R06994 R07000 R07001 R07002 R07003 R07004 R07009 R07010 R07011 R07012 R07013 R07014 R07015 R07016 R07020 R07021 R07022 R07023 R07024 R07025 R07026 R07027 R07031 R07032 R07034 R07035 R07036 R07037 R07038 R07039 R07040 R07041 R07042 R07043 R07044 R07045 R07046 R07047 R07048 R07049 R07050 R07051 R07052 R07053 R07054 R07055 R07056 R07057 R07058 R07059 R07060 R07061 R07062 R07066 R07067 R07068 R07069 R07070 R07071 R07072 R07073 R07074 R07075 R07076 R07079 R07080 R07081 R07082 R07083 R07084 R07085 R07086 R07087 R07088 R07089 R07090 R07091 R07092 R07093 R07094 R07095 R07098 R07099 R07100 R07101 R07102 R07104 R07105 R07106 R07108 R07109 R07110 R07111 R07112 R07116 R07121 R07122 R07124 R07127 R07133 R07134 R07135 R07136 R07137 R07138 R07139 R07140 R07141 R07142 R07143 R07144 R07145 R07146 R07147 R07149 R07150 R07152 R07156 R07164 R07165 R07168 R07170 R07171 R07172 R07173 R07175 R07178 R07179 R07181 R07183 R07184 R07185 R07186 R07187 R07188 R07189 R07190 R07191 R07194 R07195 R07196 R07197 R07198 R07199 R07200 R07201 R07202 R07203 R07204 R07205 R07206 R07207 R07208 R07209 R07211 R07212 R07213 R07215 R07216 R07217 R07219 R07220 R07221 R07222 R07224 R07225 R07245 R07246 R07247 R07248 R07250 R07251 R07252 R07253 R07254 R07257 R07260 R07262 R07263 R07264 R07265 R07267 R07269 R07270 R07271 R07272 R07273 R07274 R07276 R07277 R07279 R07280 R07281 R07289 R07290 R07294 R07295 R07296 R07298 R07300 R07301 R07302 R07303 R07304 R07305 R07306 R07307 R07311 R07313 R07315 R07316 R07317 R07318 R07319 R07320 R07321 R07322 R07323 R07324 R07329 R07337 R07339 R07340 R07342 R07345 R07346 R07353 R07354 R07355 R07360 R07362 R07363 R07364 R07365 R07366 R07367 R07368 R07369 R07370 R07371 R07372 R07373 R07378 R07392 R07393 R07394 R07395 R07396 R07399 R07400 R07401 R07402 R07403 R07405 R07406 R07407 R07408 R07410 R07413 R07414 R07415 R07416 R07417 R07418 R07419 R07420 R07421 R07422 R07423 R07426 R07427 R07428 R07432 R07433 R07434 R07437 R07440 R07441 R07442 R07455 R07457 R07458 R07475 R07476 R07477 R07483 R07484 R07488 R07493 R07494 R07497 R07500 R07502 R07503 R07510 R07511 R07512 R07513 R07514 R07515 R07516 R07518 R07519 R07522 R07523 R07525 R07526 R07528 R07532 R07534 R07536 R07537 R07538 R07539 R07540 R07543 R07574 R07576 R07582 R07583 R07584 R07597 R07598 R07599 R07601 R07603 R07605 R07613 R07627 R07629 R07630 R07631 R07632 R07636 R07638 R07645 R07647 R07648 R07649 R07650 R07651 R07657 R07658 R07659 R07660 R07661 R07662 R07663 R07664 R07665 R07666 R07667 R07668 R07669 R07670 R07672 R07673 R07674 R07675 R07676 R07677 R07678 R07680 R07684 R07686 R07687 R07688 R07689 R07691 R07692 R07700 R07701 R07702 R07703 R07704 R07705 R07706 R07707 R07708 R07709 R07710 R07711 R07713 R07714 R07715 R07718 R07719 R07720 R07721 R07723 R07725 R07727 R07728 R07729 R07730 R07731 R07734 R07736 R07740 R07741 R07746 R07747 R07748 R07751 R07752 R07753 R07754 R07757 R07758 R07759 R07760 R07761 R07770 R07772 R07773 R07776 R07777 R07778 R07779 R07780 R07782 R07793 R07794 R07795 R07796 R07797 R07798 R07799 R07800 R07801 R07802 R07804 R07827 R07828 R07829 R07830 R07831 R07832 R07833 R07836 R07837 R07839 R07840 R07848 R07849 R07854 R07855 R07856 R07863 R07864 R07865 R07866 R07867 R07868 R07869 R07870 R07871 R07872 R07873 R07874 R07875 R07876 R07877 R07878 R07879 R07880 R07881 R07882 R07883 R07884 R07885 R07886 R07887 R07888 R07889 R07890 R07891 R07892 R07893 R07894 R07895 R07896 R07897 R07898 R07899 R07902 R07903 R07910 R07911 R07912 R07913 R07914 R07917 R07923 R07926 R07927 R07928 R07929 R07930 R07931 R07932 R07934 R07935 R07936 R07937 R07938 R07939 R07942 R07944 R07950 R07951 R07952 R07953 R07954 R07955 R07956 R07957 R07958 R07959 R07960 R07961 R07962 R07963 R07964 R07965 R07966 R07967 R07968 R07969 R07970 R07971 R07972 R07973 R07974 R07975 R07976 R07977 R07978 R07979 R07980 R07981 R07983 R07984 R07985 R07986 R07987 R07988 R07989 R07990 R07991 R07992 R07993 R07995 R07996 R07997 R07998 R07999 R08002 R08003 R08005 R08008 R08009 R08010 R08013 R08014 R08015 R08016 R08017 R08018 R08019 R08021 R08022 R08024 R08032 R08036 R08042 R08043 R08044 R08045 R08046 R08047 R08048 R08050 datasetS2/strict_no_o2/consensus_scopes.txt0000644000175000017500000023136310747436025021053 0ustar oliveroliverConsensus scope of cluster 1 C00001 H2O C00007 Oxygen C00011 CO2 C00022 Pyruvate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00084 Acetaldehyde C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00804 Propynoate C00810 R-Acetoin C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02923 2,3-Dihydroxytoluene C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate Consensus scope of cluster 2 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00090 Catechol C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00122 Fumarate C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00217 D-Glutamate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00288 HCO3- C00292 Aniline C00295 Orotate C00311 Isocitrate C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00380 Cytosine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00463 Indole C00472 p-Benzoquinone C00483 Tyramine C00488 Formamide C00490 Itaconate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00792 D-Arginine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01353 Carbonicacid C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01769 S-Acetoin C01987 2-Aminophenol C01990 3-Oxalomalate C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03139 N-Amidino-L-aspartate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06160 S-Norcoclaurine C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06224 3,4-Dihydroxystyrene C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15523 2,6-Dihydroxynicotinate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 3 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00058 Formate C00067 Formaldehyde C00080 H+ C00085 D-Fructose6-phosphate C00089 Sucrose C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00132 Methanol C00137 myo-Inositol C00159 D-Mannose C00184 Glycerone C00185 Cellobiose C00191 D-Glucuronate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00227 Acetylphosphate C00231 D-Xylulose5-phosphate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00447 D-Sedoheptulose1,7-bisphosphate C00514 D-Mannonate C00536 Triphosphate C00546 Methylglyoxal C00577 D-Glyceraldehyde C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00629 2-Dehydro-D-gluconate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00905 D-Fructuronate C00969 3-Hydroxypropanal C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01742 Palatinose C02013 Cellotetraose C02048 Laminaribiose C02336 beta-D-Fructose C02466 Trimetaphosphate C02591 Sucrose6-phosphate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03546 myo-Inositol4-phosphate C03661 1F-beta-D-Fructosylsucrose C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05682 Phosphonoacetate C05999 Lactaldehyde C06019 D-arabino-3-Hexulose6-phosphate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone C07836 D-glycero-D-manno-Heptose7-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate Consensus scope of cluster 4 C00001 H2O C00002 ATP C00007 Oxygen C00008 ADP C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00020 AMP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00096 GDP-mannose C00099 beta-Alanine C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00179 Agmatine C00181 D-Xylose C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00270 N-Acetylneuraminate C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00286 dGTP C00288 HCO3- C00292 Aniline C00294 Inosine C00295 Orotate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00365 dUMP C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00402 D-Aspartate C00415 Dihydrofolate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00460 dUTP C00463 Indole C00472 p-Benzoquinone C00475 Cytidine C00476 D-Lyxose C00483 Tyramine C00488 Formamide C00490 Itaconate C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00508 L-Ribulose C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00526 Deoxyuridine C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00558 D-Tagaturonate C00559 Deoxyadenosine C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00575 3',5'-CyclicAMP C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00795 D-Tagatose C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00860 L-Histidinol C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00921 Dihydropteroate C00935 UDP-L-arabinose C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00988 2-Phosphoglycolate C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01133 N-Acetyl-D-glucosaminate C01146 2-Hydroxy-3-oxopropanoate C01151 D-Ribose1,5-bisphosphate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01346 dUDP C01353 Carbonicacid C01367 3'-AMP C01368 3'-UMP C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01508 L-Lyxose C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01594 Linamarin C01596 Maleamate C01602 Ornithine C01613 Stachyose C01623 UDP-apiose C01674 Chitobiose C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01742 Palatinose C01762 Xanthosine C01769 S-Acetoin C01801 Deoxyribose C01825 L-Galactose C01879 5-Oxoproline C01888 Aminoacetone C01987 2-Aminophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C02013 Cellotetraose C02048 Laminaribiose C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02280 GDP-L-galactose C02294 Methylguanidine C02305 Phosphocreatine C02330 UDP-L-iduronate C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02362 2-Oxosuccinamate C02385 AminoacidArg- C02405 Formylphosphate C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02655 6-Acetyl-D-glucose C02659 Acetonecyanohydrin C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02726 N4-Phosphoagmatine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03153 N5-Methyl-L-glutamine C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03204 10-Formyldihydrofolate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03277 Imidazol-5-yl-pyruvate C03287 L-Glutamyl5-phosphate C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03373 Aminoimidazoleribotide C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03483 Adenosinetetraphosphate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03794 N6-1,2-Dicarboxyethyl-AMP C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03872 L-Serine-phosphoethanolamine C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03971 1F-alpha-D-Galactosylraffinose C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C04006 1D-myo-Inositol3-phosphate C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04089 UDP-4-dehydro-6-deoxy-D-glucose C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04138 Nalpha-gamma-L-Glutamylhistamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04579 Inositol1,2,3,4,5-pentakisphosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05239 5-Aminoimidazole C05332 Phenethylamine C05340 beta-Alanyl-L-arginine C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05385 D-Glucuronate1-phosphate C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05512 Deoxyinosine C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05765 L-Glutamyl1-phosphate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05822 3'-CMP C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05993 Acetyladenylate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06156 alpha-D-Glucosamine1-phosphate C06160 S-Norcoclaurine C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06430 D-Galacturonolactone C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C11174 1-Diphosinositolpentakisphosphate C11355 4-Amino-4-deoxychorismate C11437 1-Deoxy-D-xylulose5-phosphate C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11500 5'-Dehydroadenosine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16186 L-Ascorbate6-phosphate C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 5 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00055 CMP C00058 Formate C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00099 beta-Alanine C00103 D-Glucose1-phosphate C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00146 Phenol C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00179 Agmatine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00243 Lactose C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00270 N-Acetylneuraminate C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00288 HCO3- C00292 Aniline C00295 Orotate C00299 Uridine C00300 Creatine C00309 D-Ribulose C00311 Isocitrate C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00365 dUMP C00380 Cytosine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00460 dUTP C00463 Indole C00472 p-Benzoquinone C00475 Cytidine C00483 Tyramine C00488 Formamide C00490 Itaconate C00492 Raffinose C00497 R-Malate C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00526 Deoxyuridine C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00988 2-Phosphoglycolate C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01133 N-Acetyl-D-glucosaminate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01326 Hydrogencyanide C01346 dUDP C01353 Carbonicacid C01368 3'-UMP C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01594 Linamarin C01596 Maleamate C01602 Ornithine C01613 Stachyose C01674 Chitobiose C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01888 Aminoacetone C01987 2-Aminophenol C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02294 Methylguanidine C02305 Phosphocreatine C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02362 2-Oxosuccinamate C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02655 6-Acetyl-D-glucose C02659 Acetonecyanohydrin C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03277 Imidazol-5-yl-pyruvate C03291 L-Xylulose5-phosphate C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03736 alpha-D-Ribose5-phosphate C03738 gamma-L-Glutamyl-D-alanine C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03872 L-Serine-phosphoethanolamine C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03971 1F-alpha-D-Galactosylraffinose C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C04006 1D-myo-Inositol3-phosphate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04089 UDP-4-dehydro-6-deoxy-D-glucose C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05332 Phenethylamine C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05822 3'-CMP C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06156 alpha-D-Glucosamine1-phosphate C06160 S-Norcoclaurine C06186 Arbutin C06187 Arbutin6-phosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06224 3,4-Dihydroxystyrene C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06655 L-N2-2-Carboxyethylarginine C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11437 1-Deoxy-D-xylulose5-phosphate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 6 C00001 H2O C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00514 D-Mannonate C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Consensus scope of cluster 7 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00022 Pyruvate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00067 Formaldehyde C00074 Phosphoenolpyruvate C00080 H+ C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00121 D-Ribose C00122 Fumarate C00132 Methanol C00137 myo-Inositol C00149 S-Malate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00216 D-Arabinose C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00252 Isomaltose C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00309 D-Ribulose C00311 Isocitrate C00345 6-Phospho-D-gluconate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00447 D-Sedoheptulose1,7-bisphosphate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00514 D-Mannonate C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00552 meso-Tartaricacid C00577 D-Glyceraldehyde C00596 2-Hydroxy-2,4-pentadienoate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00636 D-Mannose1-phosphate C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00711 Malate C00794 D-Sorbitol C00804 Propynoate C00810 R-Acetoin C00817 D-Altronate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00944 3-Dehydroquinate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01108 1,2,3-Trihydroxybenzene C01112 D-Arabinose5-phosphate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02336 beta-D-Fructose C02341 trans-Aconitate C02351 1,2-Benzoquinone C02466 Trimetaphosphate C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02753 D-Xylono-1,4-lactone C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02923 2,3-Dihydroxytoluene C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03167 Phosphonoacetaldehyde C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03736 alpha-D-Ribose5-phosphate C03765 4-Hydroxyphenylacetaldehyde C03785 D-Tagatose1,6-bisphosphate C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03947 Glycerol1,2-cyclicphosphate C03981 2-Hydroxyethylenedicarboxylate C04006 1D-myo-Inositol3-phosphate C04044 3-2,3-Dihydroxyphenylpropanoate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05616 3-O-Methylgallate C05682 Phosphonoacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06187 Arbutin6-phosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06316 D-erythro-Ascorbate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C11437 1-Deoxy-D-xylulose5-phosphate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate Consensus scope of cluster 8 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00704 O2.- C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Consensus scope of cluster 9 C00001 H2O C00011 CO2 C00014 NH3 C00080 H+ C00086 Urea C00288 HCO3- C01010 Urea-1-carboxylate C01353 Carbonicacid C01417 Cyanate C01563 Carbamate C01566 Cyanamide C06554 Cyanuricacid C06555 Biuret C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine Consensus scope of cluster 10 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00022 Pyruvate C00024 Acetyl-CoA C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00083 Malonyl-CoA C00084 Acetaldehyde C00090 Catechol C00091 Succinyl-CoA C00100 Propanoyl-CoA C00109 2-Oxobutanoate C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00313 Oxalyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00383 Malonate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00511 Propenoate C00530 p-Benzenediol C00531 Itaconyl-CoA C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00566 3S-Citryl-CoA C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00798 Formyl-CoA C00804 Propynoate C00810 R-Acetoin C00815 Citramalate C00818 D-Glucarate C00827 Lactoyl-CoA C00846 3-Oxoadipate C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00904 Citramalyl-CoA C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C00989 4-Hydroxybutanoicacid C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01213 R-2-Methyl-3-oxopropanoyl-CoA C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01757 Triacetate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02170 Methylmalonate C02214 E-Glutaconate C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02266 D-Xylonolactone C02295 Methylitaconate C02331 Vinylacetyl-CoA C02341 trans-Aconitate C02351 1,2-Benzoquinone C02411 Glutaconyl-1-CoA C02480 cis,cis-Muconate C02488 R-2-Ethylmalate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02557 Methylmalonyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C03058 2-Hydroxyglutaryl-CoA C03223 3,4-Dihydroxyphthalate C03231 3-Methylglutaconyl-CoA C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03344 2-Methylacetoacetyl-CoA C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03561 R-3-Hydroxybutanoyl-CoA C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05116 3-Hydroxybutanoyl-CoA C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05668 3-Hydroxypropionyl-CoA C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06719 Dihydrophloroglucinol C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11062 4-Hydroxybutyryl-CoA C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16268 Cyclopropanecarboxyl-CoA C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 11 C00001 H2O C00011 CO2 C00014 NH3 C00041 L-Alanine C00049 L-Aspartate C00080 H+ C00086 Urea C00099 beta-Alanine C00122 Fumarate C00133 D-Alanine C00149 S-Malate C00152 L-Asparagine C00288 HCO3- C00337 S-Dihydroorotate C00402 D-Aspartate C00429 5,6-Dihydrouracil C00438 N-Carbamoyl-L-aspartate C00497 R-Malate C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01353 Carbonicacid C01384 Maleicacid C01417 Cyanate C01563 Carbamate C01566 Cyanamide C01596 Maleamate C02512 3-Cyano-L-alanine C02642 3-Ureidopropionate C03065 3-Guanidinopropanoate C03139 N-Amidino-L-aspartate C03703 L-5-Carboxymethylhydantoin C06554 Cyanuricacid C06555 Biuret C07272 Maleimide C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine Consensus scope of cluster 12 C00001 H2O C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C01312 ProstaglandinI2 C02198 ThromboxaneA2 C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C14717 15-Deoxy-delta-12,14-PGJ2 Consensus scope of cluster 13 C00001 H2O C00011 CO2 C00014 NH3 C00062 L-Arginine C00077 L-Ornithine C00080 H+ C00086 Urea C00134 Putrescine C00148 L-Proline C00179 Agmatine C00288 HCO3- C00327 L-Citrulline C00436 N-Carbamoylputrescine C00515 D-Ornithine C00763 D-Proline C00792 D-Arginine C01010 Urea-1-carboxylate C01353 Carbonicacid C01417 Cyanate C01563 Carbamate C01566 Cyanamide C03047 1,4-Diguanidinobutane C03943 2R,4S-2,4-Diaminopentanoate C06366 Homospermidine C06554 Cyanuricacid C06555 Biuret C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine Consensus scope of cluster 14 C00001 H2O C00011 CO2 C00047 L-Lysine C00666 LL-2,6-Diaminoheptanedioate C00680 meso-2,6-Diaminoheptanedioate C00739 D-Lysine C01142 3S-3,6-Diaminohexanoate C01186 3S,5S-3,5-Diaminohexanoate C01353 Carbonicacid C01672 Cadaverine C02837 L-Lysine1,6-lactam C05161 2,5-Diaminohexanoate C05328 D-2-Amino-hexano-6-lactam Consensus scope of cluster 15 C00001 H2O C00282 Hydrogen C05421 15-cis-Phytoene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15907 1',2'-Dihydro-gamma-carotene C16276 epsilon-Carotene datasetS2/strict_no_o2/hierarchical_clusters.txt0000644000175000017500000004235610747436025022023 0ustar oliveroliverMetabolites in cluster 1: C00022 Pyruvate C00036 Oxaloacetate C00158 Citrate C00166 Phenylpyruvate C00222 3-Oxopropanoate C00251 Chorismate C00254 Prephenate C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00502 D-Xylonate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00804 Propynoate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00922 2,3-Dimethylmaleate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01163 3-Carboxy-cis,cis-muconate C01187 3-Deoxy-D-manno-octulosonate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01680 D-Fuconate C01732 Mesaconate C01934 L-Rhamnonate C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02295 Methylitaconate C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02930 2-Methyleneglutarate C02991 L-Rhamnono-1,4-lactone C03063 2-Oxohept-3-enedioate C03248 Acetylenedicarboxylate C03340 L-2,3-Dihydrodipicolinate C03453 Z-5-Oxohex-2-enedioate C03548 trans-2,3-Epoxysuccinate C03572 2-Chloro-cis,cis-muconate C03585 3-Chloro-cis,cis-muconate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04522 2-Chloro-2,5-dihydro-5-oxofuran-2-acetate C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06159 2-Dehydro-3-deoxy-D-fuconate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06581 2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate C06582 2-Hydroxy-6-oxo-7-methylocta-2,4-dienoate C06587 2-Hydroxy-6-oxo-6-4'-chlorophenyl-hexa-2,4-dienoate C06609 trans-1,3-Dichloropropene C06610 cis-1,3-Dichloropropene C06611 trans-3-Chloro-2-propene-1-ol C06612 cis-3-Chloro-2-propene-1-ol C06613 3-Chloroallylaldehyde C06614 trans-3-Chloroacrylicacid C06615 cis-3-Chloroacrylicacid C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07089 5-Chloro-2-hydroxymuconicsemialdehyde C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11354 2-Hydroxy-cis-hex-2,4-dienoate C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C12624 2-Hydroxy-6-ketononatrienedioate C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14106 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate C14107 2-Hydroxy-4-hydroxymethylbenzalpyruvate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16209 3-2-Carboxyvinylnaphthalene-2-carboxylicacid C16210 4-3-Hydroxy-2-naphthyl-2-oxobut-3-enoicacid C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16266 3-Chloro-2-hydroxymuconicsemialdehyde C16348 cis-3-Chloroallylaldehyde C16390 S-2-Hydroxymethylglutarate Metabolites in cluster 2: C00025 L-Glutamate C00051 Glutathione C00064 L-Glutamine C00065 L-Serine C00073 L-Methionine C00078 L-Tryptophan C00082 L-Tyrosine C00097 L-Cysteine C00108 Anthranilate C00127 Glutathionedisulfide C00217 D-Glutamate C00270 N-Acetylneuraminate C00328 L-Kynurenine C00355 3,4-Dihydroxy-L-phenylalanine C00437 N-Acetylornithine C00439 N-Formimino-L-glutamate C00491 L-Cystine C00542 Cystathionine C00568 4-Aminobenzoate C00606 3-Sulfino-L-alanine C00669 gamma-L-Glutamyl-L-cysteine C00716 Serine C00740 D-Serine C00793 D-Cysteine C00819 D-Glutamine C00822 Dopaquinone C00855 D-Methionine C00884 Homocarnosine C00921 Dihydropteroate C00977 L-Tryptophanamide C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01042 N-Acetyl-L-aspartate C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01047 N5-Ethyl-L-glutamine C01162 3-Pyrazol-1-yl-L-alanine C01215 2-Acetamidomethylenesuccinate C01419 Cys-Gly C01993 5'-Oxoinosine C02166 LeukotrieneC4 C02218 2-Aminoacrylate C02220 2-Aminomuconate C02237 5-Oxo-D-proline C02291 L-Cystathionine C02294 Methylguanidine C02362 2-Oxosuccinamate C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02727 N6-Acetyl-L-lysine C03015 O-Carbamoyl-L-serine C03078 4-Guanidinobutanamide C03145 N-Formyl-L-methionine C03174 S-Succinylglutathione C03227 3-Hydroxy-L-kynurenine C03409 N-Formimino-L-aspartate C03451 R-S-Lactoylglutathione C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03708 N-Acetyl-O-acetylneuraminate C03722 Pyridine-2,3-dicarboxylate C03961 erythro-3-Hydroxy-L-aspartate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04409 2-Amino-3-carboxymuconatesemialdehyde C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04690 2-Hydroxymethyl-3-acetamidomethylenesuccinate C04771 S-2-Amino-3-3-hydroxy-4-oxo-4H-pyridin-1-ylpropanoate C04776 D-Galactosyl-3-N-acetyl-beta-D-galactosaminyl-L-serine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05133 4-Imidazolone-5-acetate C05565 Hydantoin-5-propionate C05648 5-Hydroxy-N-formylkynurenine C05653 Formylanthranilate C05699 Selenocystathionine C05711 gamma-Glutamyl-beta-cyanoalanine C05730 Glutathionylspermidine C05829 N-Carbamyl-L-glutamate C05931 N-Succinyl-L-glutamate C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C06393 2,3-Diaminopropanoate C06462 LeukotrieneF4 C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C11355 4-Amino-4-deoxychorismate C11511 threo-3-Hydroxy-L-aspartate C12989 N2-Acetyl-L-lysine C14180 S-Hydroxymethylglutathione C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14803 1-Nitro-7-hydroxy-8-glutathionyl-7,8-dihydronaphthalene C14804 1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene C14805 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene C14806 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalene C14847 3,4-Dihydro-3-hydroxy-4-S-glutathionylbromobenzene C14848 2,3-Dihydro-2-S-glutathionyl-3-hydroxybromobenzene C14855 4,5-Dihydro-4-hydroxy-5-S-glutathionyl-benzoapyrene C14856 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzoapyrene C14861 S-2,2-Dichloro-1-hydroxyethylglutathione C14863 2-S-Glutathionylacetylglutathione C15767 gamma-Glutamyl-gamma-aminobutyraye Metabolites in cluster 3: C00085 D-Fructose6-phosphate C00092 D-Glucose6-phosphate C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00199 D-Ribulose5-phosphate C00231 D-Xylulose5-phosphate C00275 D-Mannose6-phosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00357 N-Acetyl-D-glucosamine6-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00620 alpha-D-Ribose1-phosphate C00636 D-Mannose1-phosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C01094 D-Fructose1-phosphate C01099 L-Fuculose1-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01131 L-Rhamnulose1-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C02591 Sucrose6-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03394 Erythrulose1-phosphate C03506 Indoleglycerolphosphate C03546 myo-Inositol4-phosphate C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04645 6-D-Glucose-1-phospho-D-mannosylglycoprotein C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05396 Lactose6-phosphate C06019 D-arabino-3-Hexulose6-phosphate C06156 alpha-D-Glucosamine1-phosphate C06187 Arbutin6-phosphate C06188 Salicin6-phosphate C06441 L-Xylulose1-phosphate Metabolites in cluster 4: C00002 ATP C00008 ADP C00016 FAD C00020 AMP C00035 GDP C00044 GTP C00053 3'-Phosphoadenylylsulfate C00054 Adenosine3',5'-bisphosphate C00081 ITP C00096 GDP-mannose C00104 IDP C00130 IMP C00144 GMP C00224 Adenylylsulfate C00286 dGTP C00301 ADP-ribose C00360 dAMP C00362 dGMP C00394 GDP-glucose C00498 ADP-glucose C00575 3',5'-CyclicAMP C00655 Xanthosine5'-phosphate C00700 XTP C00942 3',5'-CyclicGMP C01201 Nomega-ADP-D-ribosyl-L-arginine C01222 GDP-4-dehydro-6-deoxy-D-mannose C01228 Guanosine3',5'-bisdiphosphate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01367 3'-AMP C02280 GDP-L-galactose C02353 2',3'-CyclicAMP C02739 Phosphoribosyl-ATP C03483 Adenosinetetraphosphate C03614 Inosine5'-tetraphosphate C03794 N6-1,2-Dicarboxyethyl-AMP C04307 P1,P2-Bis5'-adenosyltriphosphate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04494 Guanosine3'-diphosphate5'-triphosphate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C05922 Formamidopyrimidinenucleosidetriphosphate C05993 Acetyladenylate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06197 P1,P3-Bis5'-adenosyltriphosphate C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C14830 GDP-4-keto-6-L-deoxygalactose C15925 GDP-L-gulose Metabolites in cluster 5: C00015 UDP C00029 UDP-glucose C00043 UDP-N-acetyl-D-glucosamine C00052 UDP-D-galactose C00055 CMP C00063 CTP C00075 UTP C00105 UMP C00112 CDP C00203 UDP-N-acetyl-D-galactosamine C00239 dCMP C00365 dUMP C00458 dCTP C00460 dUTP C00513 CDP-glycerol C00705 dCDP C01005 O-Phospho-L-serine C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01233 sn-glycero-3-Phosphoethanolamine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01368 3'-UMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02532 D-O-Phosphoserine C03733 UDP-alpha-D-galacto-1,4-furanose C03872 L-Serine-phosphoethanolamine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04302 N-5-Phospho-D-ribosylanthranilate C04652 UDP-2,3-bis3-hydroxytetradecanoylglucosamine C05822 3'-CMP C06198 P1,P4-Bis5'-uridyltetraphosphate C06241 N-Acetylneuraminate9-phosphate C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11521 UDP-6-sulfoquinovose Metabolites in cluster 6: C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00267 alpha-D-Glucose C00761 Coniferin C00844 R-Prunasin C01083 alpha,alpha-Trehalose C01158 1-O-Galloyl-beta-D-glucose C01533 Syringin C01742 Palatinose C01982 R-Amygdalin C02013 Cellotetraose C02074 Raucaffricine C02655 6-Acetyl-D-glucose C02827 D-Glucose6-sulfate C02964 D-Glucosyl-D-mannose C03470 3-alphaS-Strictosidine C03855 Cholesteryl-beta-D-glucoside C03915 1-O-Sinapoylbeta-D-glucoside C04218 alpha,alpha'-Trehalose6-mycolate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05403 3-Ketolactose C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C06046 Salidroside C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Metabolites in cluster 7: C00074 Phosphoenolpyruvate C00197 3-Phospho-D-glycerate C00236 3-Phospho-D-glyceroylphosphate C00345 6-Phospho-D-gluconate C00363 dTDP C00364 dTMP C00459 dTTP C00631 2-Phospho-D-glycerate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C01159 2,3-Bisphospho-D-glycerate C01236 D-Glucono-1,5-lactone6-phosphate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C02798 3-Phosphonopyruvate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C11536 2R-O-Phospho-3-sulfolactate C12106 AminoDAHP Metabolites in cluster 8: C00909 LeukotrieneA4 C02165 LeukotrieneB4 C04822 8R-HPETE C05356 5S-HPETE C05956 ProstaglandinG2 C05965 12S-HPETE C05966 15S-HPETE C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Metabolites in cluster 9: C00086 Urea C00581 Guanidinoacetate C00906 5,6-Dihydrothymine C01010 Urea-1-carboxylate C01417 Cyanate C01537 Urethane C01563 Carbamate C01566 Cyanamide C03296 N2-Succinyl-L-arginine C05100 3-Ureidoisobutyrate C06553 N-Isopropylammelide C06554 Cyanuricacid C06555 Biuret C06657 Guanidinoproclavaminicacid C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine Metabolites in cluster 10: C00024 Acetyl-CoA C00083 Malonyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00406 Feruloyl-CoA C00531 Itaconyl-CoA C00566 3S-Citryl-CoA C00904 Citramalyl-CoA C01011 3S-Citramalyl-CoA C03231 3-Methylglutaconyl-CoA C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA Metabolites in cluster 11: C00049 L-Aspartate C00152 L-Asparagine C00337 S-Dihydroorotate C00386 Carnosine C00402 D-Aspartate C00429 5,6-Dihydrouracil C00438 N-Carbamoyl-L-aspartate C01596 Maleamate C02512 3-Cyano-L-alanine C02642 3-Ureidopropionate C03065 3-Guanidinopropanoate C03139 N-Amidino-L-aspartate C03703 L-5-Carboxymethylhydantoin C04079 N-R-Pantothenoyl-L-cysteine C07272 Maleimide Metabolites in cluster 12: C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C01312 ProstaglandinI2 C02198 ThromboxaneA2 C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C14717 15-Deoxy-delta-12,14-PGJ2 Metabolites in cluster 13: C00062 L-Arginine C00077 L-Ornithine C00179 Agmatine C00327 L-Citrulline C00436 N-Carbamoylputrescine C00515 D-Ornithine C00792 D-Arginine C02253 Benzoylagmatine C03047 1,4-Diguanidinobutane C03626 NG,NG-Dimethyl-L-arginine C03943 2R,4S-2,4-Diaminopentanoate Metabolites in cluster 14: C00047 L-Lysine C00666 LL-2,6-Diaminoheptanedioate C00680 meso-2,6-Diaminoheptanedioate C00739 D-Lysine C01142 3S-3,6-Diaminohexanoate C01186 3S,5S-3,5-Diaminohexanoate C02837 L-Lysine1,6-lactam C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C05161 2,5-Diaminohexanoate C05328 D-2-Amino-hexano-6-lactam C05552 N6-D-Biotinyl-L-lysine Metabolites in cluster 15: C05421 15-cis-Phytoene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15870 Rhodopin C15907 1',2'-Dihydro-gamma-carotene C16276 epsilon-Carotene datasetS2/semiStrict/0000755000175000017500000000000010747436025014430 5ustar oliveroliverdatasetS2/semiStrict/reaction_list.txt0000644000175000017500000011345710747436025020043 0ustar oliveroliverR00002 R00004 R00005 R00006 R00008 R00009 R00010 R00011 R00012 R00013 R00014 R00015 R00016 R00017 R00018 R00019 R00021 R00022 R00023 R00024 R00025 R00026 R00027 R00028 R00029 R00031 R00032 R00033 R00034 R00035 R00036 R00038 R00039 R00040 R00042 R00043 R00044 R00045 R00047 R00048 R00049 R00053 R00054 R00055 R00058 R00059 R00060 R00061 R00062 R00063 R00064 R00066 R00067 R00068 R00069 R00070 R00072 R00073 R00074 R00075 R00076 R00077 R00078 R00080 R00081 R00082 R00083 R00084 R00085 R00086 R00087 R00088 R00089 R00090 R00091 R00092 R00093 R00094 R00095 R00097 R00099 R00100 R00101 R00102 R00103 R00104 R00105 R00106 R00107 R00108 R00109 R00111 R00112 R00113 R00114 R00115 R00116 R00118 R00119 R00120 R00121 R00122 R00123 R00124 R00125 R00126 R00127 R00128 R00129 R00130 R00131 R00132 R00134 R00136 R00137 R00138 R00139 R00140 R00143 R00148 R00149 R00150 R00153 R00155 R00156 R00157 R00158 R00159 R00160 R00161 R00173 R00174 R00175 R00177 R00178 R00179 R00180 R00181 R00182 R00183 R00184 R00185 R00186 R00187 R00188 R00189 R00190 R00191 R00192 R00193 R00194 R00195 R00196 R00197 R00198 R00199 R00200 R00203 R00205 R00206 R00207 R00208 R00209 R00210 R00211 R00212 R00213 R00214 R00215 R00216 R00217 R00218 R00219 R00220 R00221 R00223 R00224 R00226 R00227 R00228 R00229 R00230 R00233 R00235 R00236 R00237 R00238 R00239 R00240 R00241 R00243 R00245 R00248 R00250 R00251 R00253 R00254 R00256 R00257 R00258 R00259 R00260 R00261 R00262 R00264 R00265 R00267 R00268 R00269 R00270 R00271 R00272 R00273 R00274 R00275 R00276 R00277 R00278 R00279 R00280 R00281 R00282 R00283 R00284 R00286 R00287 R00289 R00291 R00293 R00294 R00295 R00296 R00297 R00298 R00299 R00300 R00301 R00302 R00303 R00304 R00305 R00306 R00307 R00310 R00311 R00312 R00313 R00314 R00315 R00316 R00317 R00318 R00319 R00320 R00321 R00322 R00324 R00325 R00326 R00327 R00328 R00330 R00332 R00335 R00336 R00337 R00338 R00339 R00340 R00341 R00342 R00343 R00344 R00345 R00346 R00347 R00348 R00350 R00351 R00352 R00353 R00354 R00355 R00356 R00357 R00359 R00360 R00361 R00362 R00363 R00364 R00365 R00366 R00367 R00368 R00369 R00370 R00371 R00372 R00373 R00381 R00382 R00396 R00397 R00398 R00399 R00400 R00401 R00402 R00405 R00406 R00407 R00408 R00409 R00410 R00411 R00412 R00414 R00415 R00416 R00418 R00420 R00421 R00422 R00423 R00424 R00425 R00426 R00428 R00429 R00430 R00431 R00432 R00434 R00445 R00446 R00447 R00448 R00449 R00451 R00452 R00453 R00454 R00457 R00458 R00460 R00461 R00462 R00463 R00465 R00466 R00468 R00469 R00470 R00471 R00472 R00473 R00474 R00475 R00476 R00477 R00478 R00479 R00480 R00481 R00482 R00483 R00484 R00485 R00486 R00487 R00488 R00489 R00490 R00491 R00494 R00497 R00499 R00500 R00501 R00502 R00503 R00504 R00505 R00507 R00508 R00509 R00510 R00511 R00512 R00513 R00514 R00515 R00516 R00517 R00518 R00519 R00521 R00522 R00524 R00525 R00526 R00527 R00528 R00529 R00530 R00531 R00532 R00533 R00534 R00535 R00536 R00537 R00548 R00549 R00550 R00551 R00552 R00554 R00555 R00556 R00557 R00558 R00559 R00562 R00563 R00565 R00566 R00567 R00568 R00569 R00570 R00571 R00572 R00573 R00574 R00575 R00576 R00578 R00579 R00580 R00581 R00582 R00584 R00585 R00586 R00588 R00589 R00590 R00602 R00603 R00604 R00605 R00606 R00608 R00609 R00610 R00611 R00612 R00614 R00615 R00616 R00617 R00618 R00619 R00621 R00622 R00640 R00642 R00643 R00644 R00645 R00646 R00647 R00648 R00649 R00650 R00651 R00652 R00653 R00654 R00655 R00656 R00657 R00658 R00659 R00660 R00661 R00662 R00664 R00665 R00666 R00667 R00668 R00669 R00670 R00671 R00672 R00673 R00674 R00675 R00676 R00677 R00678 R00679 R00681 R00682 R00683 R00684 R00685 R00686 R00687 R00688 R00689 R00690 R00691 R00692 R00693 R00694 R00695 R00697 R00699 R00700 R00702 R00703 R00704 R00705 R00706 R00707 R00708 R00709 R00710 R00711 R00713 R00714 R00715 R00716 R00717 R00718 R00719 R00720 R00722 R00723 R00724 R00725 R00726 R00727 R00728 R00729 R00730 R00731 R00732 R00733 R00734 R00735 R00736 R00737 R00739 R00740 R00742 R00743 R00744 R00746 R00747 R00748 R00749 R00750 R00751 R00753 R00754 R00755 R00756 R00758 R00760 R00761 R00762 R00763 R00764 R00765 R00766 R00767 R00768 R00769 R00770 R00771 R00772 R00774 R00775 R00776 R00777 R00778 R00781 R00782 R00783 R00784 R00785 R00787 R00789 R00790 R00791 R00792 R00793 R00794 R00796 R00798 R00799 R00800 R00801 R00802 R00803 R00804 R00805 R00806 R00807 R00808 R00809 R00810 R00812 R00813 R00814 R00815 R00816 R00817 R00818 R00819 R00820 R00821 R00822 R00823 R00825 R00827 R00828 R00829 R00830 R00831 R00832 R00833 R00834 R00835 R00836 R00837 R00838 R00839 R00840 R00841 R00842 R00844 R00845 R00846 R00847 R00848 R00849 R00850 R00853 R00854 R00855 R00856 R00858 R00859 R00860 R00861 R00863 R00864 R00865 R00866 R00867 R00868 R00870 R00871 R00872 R00873 R00874 R00875 R00876 R00877 R00878 R00880 R00881 R00883 R00885 R00887 R00888 R00889 R00892 R00893 R00894 R00895 R00896 R00897 R00899 R00900 R00901 R00903 R00904 R00905 R00906 R00907 R00908 R00909 R00910 R00911 R00912 R00913 R00914 R00919 R00920 R00921 R00922 R00923 R00924 R00925 R00926 R00927 R00928 R00930 R00931 R00932 R00934 R00935 R00936 R00937 R00939 R00940 R00941 R00942 R00943 R00944 R00945 R00946 R00947 R00948 R00949 R00951 R00952 R00953 R00954 R00955 R00956 R00957 R00959 R00960 R00961 R00962 R00963 R00964 R00965 R00966 R00967 R00968 R00969 R00970 R00973 R00974 R00975 R00976 R00977 R00978 R00979 R00980 R00982 R00983 R00984 R00985 R00986 R00987 R00988 R00989 R00990 R00994 R00995 R00996 R00997 R00998 R00999 R01000 R01001 R01010 R01011 R01012 R01014 R01015 R01016 R01019 R01020 R01021 R01022 R01023 R01025 R01026 R01027 R01028 R01030 R01031 R01032 R01033 R01034 R01036 R01039 R01041 R01043 R01044 R01045 R01047 R01048 R01049 R01050 R01051 R01052 R01053 R01054 R01055 R01056 R01057 R01058 R01059 R01061 R01063 R01064 R01066 R01067 R01068 R01069 R01070 R01071 R01072 R01073 R01074 R01075 R01076 R01077 R01078 R01079 R01080 R01081 R01082 R01083 R01085 R01086 R01087 R01088 R01089 R01090 R01091 R01092 R01093 R01094 R01095 R01096 R01097 R01098 R01099 R01100 R01101 R01103 R01104 R01106 R01108 R01109 R01110 R01111 R01112 R01113 R01115 R01117 R01120 R01121 R01123 R01126 R01127 R01128 R01130 R01131 R01132 R01134 R01135 R01137 R01138 R01139 R01140 R01142 R01143 R01144 R01145 R01146 R01147 R01148 R01149 R01150 R01151 R01152 R01153 R01154 R01155 R01156 R01157 R01158 R01159 R01160 R01161 R01163 R01164 R01166 R01167 R01168 R01169 R01171 R01172 R01173 R01174 R01175 R01176 R01177 R01178 R01179 R01180 R01181 R01182 R01183 R01184 R01185 R01186 R01187 R01188 R01189 R01190 R01191 R01192 R01193 R01194 R01195 R01196 R01197 R01199 R01200 R01201 R01202 R01203 R01204 R01205 R01207 R01209 R01210 R01211 R01212 R01213 R01214 R01215 R01216 R01217 R01218 R01220 R01221 R01224 R01225 R01226 R01227 R01228 R01229 R01230 R01231 R01232 R01233 R01234 R01238 R01239 R01240 R01241 R01243 R01244 R01245 R01246 R01248 R01249 R01251 R01252 R01253 R01255 R01256 R01257 R01266 R01267 R01268 R01269 R01270 R01271 R01273 R01274 R01277 R01278 R01279 R01280 R01281 R01282 R01283 R01285 R01286 R01287 R01289 R01290 R01291 R01292 R01293 R01294 R01295 R01296 R01297 R01298 R01299 R01300 R01301 R01302 R01303 R01304 R01305 R01306 R01307 R01308 R01322 R01323 R01324 R01325 R01326 R01327 R01329 R01330 R01333 R01334 R01335 R01336 R01353 R01354 R01355 R01357 R01358 R01359 R01360 R01361 R01364 R01365 R01366 R01367 R01370 R01371 R01372 R01373 R01374 R01375 R01376 R01377 R01378 R01381 R01384 R01385 R01386 R01387 R01388 R01390 R01392 R01393 R01394 R01395 R01396 R01397 R01398 R01399 R01400 R01401 R01402 R01408 R01410 R01411 R01412 R01413 R01414 R01415 R01416 R01417 R01418 R01419 R01420 R01421 R01422 R01423 R01424 R01425 R01426 R01429 R01430 R01431 R01432 R01434 R01437 R01440 R01441 R01442 R01443 R01444 R01445 R01446 R01447 R01448 R01449 R01450 R01451 R01452 R01453 R01454 R01456 R01457 R01459 R01460 R01463 R01465 R01466 R01467 R01468 R01469 R01470 R01471 R01473 R01474 R01476 R01481 R01482 R01483 R01484 R01485 R01486 R01487 R01488 R01489 R01490 R01491 R01504 R01505 R01506 R01507 R01508 R01509 R01510 R01511 R01512 R01513 R01514 R01515 R01516 R01517 R01518 R01519 R01520 R01521 R01522 R01523 R01524 R01525 R01526 R01528 R01529 R01530 R01533 R01535 R01537 R01538 R01540 R01541 R01542 R01543 R01544 R01547 R01548 R01549 R01550 R01553 R01555 R01556 R01557 R01558 R01559 R01560 R01561 R01562 R01563 R01564 R01565 R01566 R01567 R01568 R01569 R01570 R01571 R01573 R01574 R01575 R01576 R01577 R01579 R01580 R01582 R01583 R01584 R01585 R01586 R01587 R01588 R01589 R01590 R01593 R01594 R01595 R01596 R01598 R01599 R01600 R01601 R01602 R01604 R01607 R01608 R01609 R01610 R01611 R01612 R01613 R01614 R01615 R01616 R01617 R01618 R01619 R01620 R01621 R01627 R01628 R01629 R01630 R01631 R01632 R01633 R01634 R01635 R01636 R01639 R01641 R01644 R01645 R01647 R01648 R01649 R01650 R01651 R01652 R01653 R01654 R01655 R01657 R01658 R01659 R01660 R01662 R01663 R01664 R01665 R01666 R01667 R01668 R01669 R01670 R01676 R01677 R01678 R01679 R01680 R01681 R01682 R01683 R01684 R01685 R01688 R01689 R01690 R01694 R01695 R01696 R01697 R01698 R01703 R01704 R01707 R01708 R01709 R01710 R01711 R01712 R01713 R01714 R01715 R01716 R01717 R01718 R01719 R01720 R01721 R01722 R01723 R01724 R01726 R01728 R01730 R01731 R01732 R01735 R01736 R01737 R01738 R01739 R01740 R01741 R01742 R01745 R01747 R01748 R01749 R01750 R01751 R01752 R01754 R01756 R01757 R01758 R01759 R01761 R01763 R01764 R01766 R01767 R01768 R01769 R01770 R01771 R01773 R01775 R01776 R01777 R01781 R01782 R01784 R01785 R01786 R01787 R01788 R01789 R01793 R01794 R01795 R01803 R01804 R01805 R01806 R01807 R01808 R01809 R01810 R01811 R01812 R01813 R01814 R01815 R01816 R01817 R01818 R01819 R01825 R01826 R01827 R01829 R01830 R01833 R01834 R01835 R01836 R01837 R01838 R01839 R01840 R01841 R01843 R01844 R01845 R01846 R01847 R01848 R01849 R01850 R01851 R01855 R01856 R01857 R01858 R01859 R01860 R01861 R01863 R01866 R01867 R01868 R01869 R01870 R01872 R01873 R01874 R01876 R01877 R01878 R01879 R01880 R01881 R01882 R01883 R01884 R01885 R01886 R01887 R01888 R01889 R01890 R01892 R01893 R01896 R01898 R01899 R01900 R01901 R01902 R01903 R01904 R01905 R01906 R01908 R01909 R01910 R01911 R01912 R01914 R01915 R01916 R01917 R01918 R01919 R01920 R01921 R01922 R01923 R01925 R01926 R01927 R01928 R01929 R01930 R01931 R01932 R01933 R01934 R01936 R01937 R01938 R01939 R01940 R01941 R01942 R01943 R01944 R01945 R01946 R01951 R01954 R01956 R01957 R01959 R01960 R01961 R01962 R01963 R01964 R01965 R01967 R01968 R01969 R01971 R01972 R01973 R01974 R01975 R01976 R01977 R01978 R01980 R01981 R01983 R01984 R01986 R01987 R01989 R01990 R01991 R01992 R01993 R01994 R01995 R01996 R01997 R02000 R02002 R02003 R02004 R02006 R02007 R02009 R02010 R02011 R02012 R02013 R02032 R02034 R02035 R02036 R02037 R02038 R02047 R02048 R02050 R02058 R02059 R02060 R02061 R02063 R02064 R02065 R02068 R02069 R02071 R02073 R02075 R02076 R02077 R02078 R02079 R02080 R02081 R02082 R02083 R02084 R02085 R02086 R02087 R02088 R02089 R02090 R02091 R02092 R02093 R02094 R02095 R02096 R02097 R02098 R02099 R02100 R02101 R02102 R02103 R02106 R02107 R02113 R02118 R02119 R02123 R02124 R02125 R02126 R02129 R02130 R02131 R02132 R02133 R02134 R02135 R02136 R02137 R02139 R02141 R02142 R02143 R02144 R02145 R02147 R02148 R02150 R02152 R02153 R02154 R02155 R02156 R02157 R02158 R02159 R02160 R02167 R02168 R02171 R02172 R02173 R02174 R02177 R02178 R02179 R02193 R02194 R02195 R02196 R02197 R02199 R02200 R02201 R02203 R02204 R02205 R02206 R02207 R02208 R02209 R02210 R02211 R02212 R02213 R02214 R02215 R02216 R02217 R02218 R02219 R02220 R02221 R02222 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R05317 R05318 R05319 R05320 R05321 R05322 R05323 R05324 R05325 R05326 R05328 R05330 R05331 R05332 R05334 R05335 R05336 R05337 R05338 R05339 R05341 R05346 R05347 R05348 R05349 R05350 R05351 R05352 R05353 R05354 R05355 R05356 R05357 R05358 R05359 R05360 R05361 R05362 R05363 R05364 R05365 R05366 R05367 R05368 R05369 R05370 R05371 R05372 R05373 R05374 R05375 R05376 R05377 R05378 R05379 R05380 R05381 R05382 R05383 R05384 R05385 R05386 R05387 R05388 R05389 R05390 R05391 R05392 R05393 R05394 R05395 R05396 R05397 R05398 R05399 R05400 R05401 R05402 R05403 R05404 R05405 R05406 R05407 R05408 R05409 R05410 R05411 R05412 R05413 R05414 R05415 R05416 R05417 R05418 R05419 R05420 R05421 R05422 R05423 R05424 R05425 R05426 R05427 R05428 R05429 R05430 R05431 R05432 R05433 R05434 R05435 R05436 R05437 R05438 R05439 R05440 R05441 R05442 R05443 R05444 R05445 R05446 R05447 R05448 R05449 R05450 R05451 R05452 R05453 R05454 R05455 R05456 R05457 R05458 R05459 R05460 R05461 R05462 R05464 R05465 R05466 R05467 R05468 R05469 R05471 R05475 R05476 R05477 R05478 R05481 R05482 R05483 R05484 R05485 R05486 R05487 R05488 R05489 R05490 R05491 R05492 R05493 R05494 R05495 R05496 R05497 R05498 R05499 R05500 R05501 R05502 R05503 R05504 R05505 R05506 R05507 R05508 R05509 R05510 R05511 R05513 R05515 R05516 R05517 R05518 R05519 R05520 R05525 R05526 R05527 R05528 R05529 R05530 R05531 R05532 R05533 R05534 R05535 R05536 R05537 R05538 R05540 R05541 R05542 R05543 R05544 R05546 R05547 R05548 R05549 R05551 R05552 R05553 R05554 R05555 R05558 R05559 R05560 R05561 R05562 R05563 R05564 R05565 R05566 R05567 R05568 R05569 R05571 R05572 R05573 R05574 R05575 R05576 R05579 R05581 R05582 R05583 R05584 R05585 R05586 R05587 R05588 R05590 R05591 R05592 R05593 R05594 R05595 R05596 R05597 R05598 R05599 R05600 R05601 R05602 R05603 R05604 R05605 R05606 R05607 R05608 R05609 R05610 R05612 R05613 R05615 R05616 R05618 R05619 R05620 R05621 R05622 R05623 R05626 R05627 R05628 R05629 R05630 R05632 R05633 R05634 R05636 R05637 R05639 R05640 R05641 R05642 R05643 R05644 R05645 R05646 R05647 R05648 R05649 R05650 R05651 R05652 R05653 R05654 R05655 R05656 R05657 R05658 R05659 R05660 R05661 R05662 R05663 R05664 R05665 R05668 R05669 R05671 R05672 R05673 R05674 R05676 R05677 R05678 R05679 R05680 R05681 R05683 R05684 R05685 R05686 R05687 R05688 R05689 R05690 R05691 R05692 R05693 R05694 R05695 R05696 R05697 R05698 R05699 R05700 R05701 R05702 R05703 R05704 R05705 R05706 R05707 R05708 R05711 R05712 R05713 R05714 R05715 R05716 R05717 R05718 R05719 R05720 R05721 R05722 R05723 R05724 R05725 R05727 R05728 R05729 R05730 R05731 R05732 R05733 R05734 R05735 R05736 R05737 R05738 R05739 R05740 R05741 R05742 R05743 R05744 R05745 R05746 R05747 R05748 R05749 R05750 R05751 R05752 R05753 R05754 R05755 R05756 R05757 R05758 R05759 R05760 R05761 R05762 R05763 R05764 R05765 R05766 R05767 R05768 R05769 R05771 R05772 R05773 R05774 R05775 R05776 R05777 R05778 R05779 R05780 R05781 R05783 R05784 R05789 R05790 R05791 R05793 R05799 R05800 R05801 R05804 R05805 R05807 R05808 R05809 R05810 R05811 R05812 R05813 R05814 R05815 R05816 R05817 R05818 R05819 R05822 R05823 R05824 R05825 R05826 R05827 R05828 R05829 R05830 R05831 R05832 R05833 R05834 R05835 R05836 R05838 R05839 R05841 R05842 R05843 R05844 R05845 R05846 R05847 R05848 R05849 R05850 R05852 R05853 R05854 R05855 R05856 R05857 R05858 R05859 R05861 R05862 R05863 R05864 R05865 R05866 R05869 R05870 R05873 R05874 R05875 R05876 R05877 R05878 R05879 R05880 R05881 R05882 R05884 R05885 R05895 R05897 R05898 R06047 R06048 R06054 R06063 R06064 R06117 R06119 R06120 R06126 R06137 R06146 R06154 R06166 R06171 R06180 R06223 R06254 R06255 R06256 R06257 R06265 R06266 R06267 R06268 R06269 R06270 R06271 R06272 R06284 R06286 R06288 R06291 R06292 R06293 R06294 R06295 R06296 R06297 R06298 R06299 R06300 R06301 R06302 R06303 R06304 R06305 R06306 R06307 R06308 R06309 R06310 R06311 R06312 R06322 R06323 R06325 R06335 R06336 R06337 R06338 R06342 R06343 R06344 R06345 R06346 R06349 R06354 R06355 R06356 R06366 R06367 R06368 R06369 R06370 R06371 R06372 R06373 R06374 R06375 R06376 R06377 R06378 R06379 R06380 R06381 R06382 R06383 R06384 R06385 R06394 R06395 R06398 R06399 R06400 R06401 R06402 R06403 R06404 R06405 R06406 R06407 R06408 R06411 R06412 R06413 R06414 R06415 R06417 R06418 R06419 R06420 R06422 R06423 R06424 R06426 R06427 R06428 R06429 R06430 R06431 R06432 R06433 R06434 R06435 R06436 R06437 R06438 R06439 R06440 R06441 R06446 R06447 R06450 R06451 R06452 R06454 R06455 R06456 R06457 R06460 R06461 R06462 R06463 R06464 R06465 R06466 R06467 R06468 R06469 R06470 R06471 R06472 R06473 R06474 R06475 R06476 R06477 R06478 R06479 R06484 R06485 R06486 R06487 R06488 R06489 R06490 R06491 R06492 R06493 R06494 R06495 R06496 R06497 R06498 R06499 R06500 R06501 R06502 R06506 R06510 R06511 R06512 R06513 R06514 R06516 R06520 R06521 R06523 R06524 R06525 R06529 R06530 R06532 R06533 R06534 R06535 R06536 R06537 R06538 R06539 R06540 R06541 R06542 R06543 R06544 R06545 R06546 R06551 R06553 R06554 R06556 R06557 R06558 R06559 R06560 R06561 R06562 R06563 R06564 R06569 R06570 R06571 R06572 R06573 R06574 R06575 R06576 R06577 R06578 R06582 R06583 R06585 R06589 R06590 R06591 R06592 R06593 R06594 R06595 R06597 R06599 R06601 R06602 R06603 R06604 R06605 R06606 R06607 R06610 R06611 R06612 R06613 R06615 R06617 R06621 R06622 R06624 R06626 R06627 R06628 R06629 R06630 R06631 R06633 R06634 R06649 R06650 R06659 R06660 R06662 R06664 R06665 R06666 R06667 R06668 R06675 R06676 R06677 R06678 R06680 R06681 R06682 R06684 R06686 R06689 R06692 R06694 R06695 R06698 R06699 R06715 R06716 R06717 R06718 R06719 R06720 R06728 R06729 R06730 R06733 R06734 R06740 R06741 R06744 R06750 R06757 R06758 R06759 R06767 R06769 R06770 R06771 R06772 R06773 R06774 R06776 R06777 R06778 R06782 R06783 R06784 R06785 R06786 R06787 R06788 R06789 R06792 R06793 R06794 R06795 R06796 R06797 R06799 R06800 R06801 R06802 R06803 R06804 R06805 R06806 R06807 R06808 R06809 R06810 R06811 R06812 R06813 R06814 R06815 R06816 R06817 R06818 R06819 R06820 R06821 R06824 R06826 R06827 R06828 R06829 R06830 R06831 R06832 R06833 R06834 R06835 R06836 R06838 R06839 R06840 R06842 R06843 R06844 R06845 R06846 R06847 R06848 R06851 R06852 R06853 R06854 R06855 R06856 R06857 R06858 R06859 R06860 R06861 R06862 R06863 R06866 R06868 R06869 R06870 R06871 R06876 R06877 R06878 R06879 R06882 R06883 R06884 R06885 R06886 R06887 R06888 R06889 R06890 R06891 R06892 R06893 R06894 R06895 R06896 R06897 R06898 R06899 R06903 R06904 R06905 R06906 R06907 R06908 R06909 R06910 R06911 R06912 R06913 R06914 R06915 R06916 R06917 R06918 R06919 R06920 R06921 R06922 R06923 R06924 R06925 R06926 R06927 R06928 R06930 R06931 R06932 R06933 R06934 R06935 R06936 R06937 R06939 R06940 R06941 R06942 R06943 R06944 R06945 R06946 R06947 R06948 R06949 R06950 R06951 R06952 R06953 R06954 R06956 R06957 R06958 R06960 R06961 R06962 R06963 R06965 R06966 R06967 R06968 R06969 R06970 R06971 R06972 R06973 R06974 R06975 R06976 R06977 R06978 R06979 R06980 R06981 R06982 R06983 R06985 R06987 R06988 R06989 R06990 R06993 R06994 R06996 R06999 R07000 R07001 R07002 R07003 R07004 R07009 R07010 R07011 R07012 R07013 R07014 R07015 R07016 R07017 R07019 R07020 R07021 R07022 R07023 R07024 R07025 R07026 R07027 R07029 R07031 R07032 R07034 R07035 R07036 R07037 R07038 R07039 R07040 R07041 R07042 R07043 R07044 R07045 R07046 R07047 R07048 R07049 R07050 R07051 R07052 R07053 R07054 R07055 R07056 R07057 R07058 R07059 R07060 R07061 R07062 R07063 R07066 R07067 R07068 R07069 R07070 R07071 R07072 R07073 R07074 R07075 R07076 R07077 R07078 R07079 R07080 R07081 R07082 R07083 R07084 R07085 R07086 R07087 R07088 R07089 R07090 R07091 R07092 R07093 R07094 R07095 R07098 R07099 R07100 R07101 R07102 R07104 R07105 R07106 R07107 R07108 R07109 R07110 R07111 R07112 R07113 R07116 R07117 R07120 R07121 R07122 R07124 R07125 R07127 R07128 R07132 R07133 R07134 R07135 R07136 R07137 R07138 R07139 R07140 R07141 R07142 R07143 R07144 R07145 R07146 R07147 R07149 R07150 R07151 R07152 R07153 R07154 R07156 R07157 R07159 R07160 R07161 R07163 R07164 R07165 R07167 R07168 R07169 R07170 R07171 R07172 R07173 R07174 R07175 R07177 R07178 R07179 R07181 R07182 R07183 R07184 R07185 R07186 R07187 R07188 R07189 R07190 R07191 R07192 R07193 R07194 R07195 R07196 R07197 R07198 R07199 R07200 R07201 R07202 R07203 R07204 R07205 R07206 R07207 R07208 R07209 R07211 R07212 R07213 R07214 R07215 R07216 R07217 R07218 R07219 R07220 R07221 R07222 R07223 R07224 R07225 R07229 R07230 R07231 R07235 R07236 R07237 R07238 R07239 R07240 R07241 R07242 R07243 R07244 R07245 R07246 R07247 R07248 R07250 R07251 R07252 R07253 R07254 R07257 R07260 R07262 R07263 R07264 R07265 R07267 R07268 R07269 R07270 R07271 R07272 R07273 R07274 R07276 R07277 R07279 R07280 R07281 R07286 R07287 R07289 R07290 R07294 R07295 R07296 R07298 R07300 R07301 R07302 R07303 R07304 R07305 R07306 R07307 R07311 R07312 R07313 R07315 R07316 R07317 R07318 R07319 R07320 R07321 R07322 R07323 R07324 R07329 R07330 R07337 R07339 R07340 R07342 R07343 R07345 R07346 R07347 R07348 R07349 R07350 R07353 R07354 R07355 R07356 R07357 R07358 R07359 R07360 R07361 R07362 R07363 R07364 R07365 R07366 R07367 R07368 R07369 R07370 R07371 R07372 R07373 R07374 R07375 R07378 R07392 R07393 R07394 R07395 R07396 R07399 R07400 R07401 R07402 R07403 R07404 R07405 R07406 R07407 R07408 R07409 R07410 R07413 R07414 R07415 R07416 R07417 R07418 R07419 R07420 R07421 R07422 R07423 R07426 R07427 R07428 R07429 R07430 R07431 R07432 R07433 R07434 R07437 R07440 R07441 R07442 R07443 R07444 R07445 R07446 R07447 R07448 R07449 R07450 R07451 R07452 R07453 R07454 R07455 R07457 R07458 R07459 R07460 R07461 R07462 R07463 R07464 R07465 R07466 R07467 R07468 R07469 R07470 R07472 R07473 R07474 R07475 R07476 R07477 R07481 R07483 R07484 R07486 R07487 R07488 R07489 R07491 R07492 R07493 R07494 R07495 R07497 R07498 R07499 R07500 R07501 R07502 R07503 R07504 R07505 R07506 R07507 R07510 R07511 R07512 R07513 R07514 R07515 R07516 R07517 R07518 R07519 R07520 R07521 R07522 R07523 R07524 R07525 R07526 R07527 R07528 R07529 R07532 R07534 R07535 R07536 R07537 R07538 R07539 R07540 R07541 R07542 R07543 R07551 R07560 R07574 R07576 R07577 R07582 R07583 R07584 R07597 R07598 R07599 R07601 R07603 R07605 R07612 R07613 R07627 R07629 R07630 R07631 R07632 R07633 R07634 R07636 R07638 R07640 R07641 R07643 R07644 R07645 R07646 R07647 R07648 R07649 R07650 R07651 R07653 R07657 R07658 R07659 R07660 R07661 R07662 R07663 R07664 R07665 R07666 R07667 R07668 R07669 R07670 R07672 R07673 R07674 R07675 R07676 R07677 R07678 R07679 R07680 R07682 R07683 R07684 R07686 R07687 R07688 R07689 R07691 R07692 R07698 R07699 R07700 R07701 R07702 R07703 R07704 R07705 R07706 R07707 R07708 R07709 R07710 R07711 R07712 R07713 R07714 R07715 R07716 R07718 R07719 R07720 R07721 R07723 R07724 R07725 R07727 R07728 R07729 R07730 R07731 R07734 R07736 R07737 R07738 R07739 R07740 R07741 R07745 R07746 R07747 R07748 R07751 R07752 R07753 R07754 R07757 R07758 R07759 R07760 R07761 R07770 R07772 R07773 R07774 R07775 R07776 R07777 R07778 R07779 R07780 R07781 R07782 R07793 R07794 R07795 R07796 R07797 R07798 R07799 R07800 R07801 R07802 R07804 R07827 R07828 R07829 R07830 R07831 R07832 R07833 R07835 R07836 R07837 R07839 R07840 R07848 R07849 R07854 R07855 R07856 R07857 R07858 R07861 R07863 R07864 R07865 R07866 R07867 R07868 R07869 R07870 R07871 R07872 R07873 R07874 R07875 R07876 R07877 R07878 R07879 R07880 R07881 R07882 R07883 R07884 R07885 R07886 R07887 R07888 R07889 R07890 R07891 R07892 R07893 R07894 R07895 R07896 R07897 R07898 R07899 R07902 R07903 R07910 R07911 R07912 R07913 R07914 R07917 R07918 R07919 R07920 R07921 R07922 R07923 R07926 R07927 R07928 R07929 R07930 R07931 R07932 R07933 R07934 R07935 R07936 R07937 R07938 R07939 R07942 R07944 R07946 R07949 R07950 R07951 R07952 R07953 R07954 R07955 R07956 R07957 R07958 R07959 R07960 R07961 R07962 R07963 R07964 R07965 R07966 R07967 R07968 R07969 R07970 R07971 R07972 R07973 R07974 R07975 R07976 R07977 R07978 R07979 R07980 R07981 R07982 R07983 R07984 R07985 R07986 R07987 R07988 R07989 R07990 R07991 R07992 R07993 R07995 R07996 R07997 R07998 R07999 R08000 R08001 R08002 R08003 R08005 R08008 R08009 R08010 R08013 R08014 R08015 R08016 R08017 R08018 R08019 R08021 R08022 R08024 R08032 R08036 R08042 R08043 R08044 R08045 R08046 R08047 R08048 R08050 datasetS2/semiStrict/consensus_scopes.txt0000644000175000017500000101155510747436025020575 0ustar oliveroliverConsensus scope of cluster 1 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00088 Nitrite C00090 Catechol C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00122 Fumarate C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00217 D-Glutamate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00242 Guanine C00244 Nitrate C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00262 Hypoxanthine C00266 Glycolaldehyde C00282 Hydrogen C00288 HCO3- C00292 Aniline C00295 Orotate C00311 Isocitrate C00315 Spermidine C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00441 L-Aspartate4-semialdehyde C00463 Indole C00472 p-Benzoquinone C00483 Tyramine C00488 Formamide C00490 Itaconate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00612 N1-Acetylspermidine C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00697 Nitrogen C00704 O2.- C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00792 D-Arginine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00986 1,3-Diaminopropane C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01029 N8-Acetylspermidine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01328 HO- C01353 Carbonicacid C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01456 Tropate C01468 4-Cresol C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01667 Bacitracin C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01769 S-Acetoin C01837 Nitroethane C01987 2-Aminophenol C01990 3-Oxalomalate C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02116 2-Nitropropane C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03340 L-2,3-Dihydrodipicolinate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05239 5-Aminoimidazole C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05640 Cinnavalininate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05658 Indoxyl C05665 beta-Aminopropionaldehyde C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06160 S-Norcoclaurine C06195 Imidazolone C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06986 Spirodilactone C07086 Phenylaceticacid C07103 2-Hydroxy-1,4-benzoquinone C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15523 2,6-Dihydroxynicotinate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C15809 Iminoglycine C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 2 C00001 H2O C00007 Oxygen C00011 CO2 C00022 Pyruvate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00084 Acetaldehyde C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00804 Propynoate C00810 R-Acetoin C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02266 D-Xylonolactone C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate Consensus scope of cluster 3 C00001 H2O C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00007 Oxygen C00008 ADP C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00016 FAD C00018 Pyridoxalphosphate C00020 AMP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00047 L-Lysine C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00061 FMN C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00072 Ascorbate C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00088 Nitrite C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00096 GDP-mannose C00099 beta-Alanine C00101 Tetrahydrofolate C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00113 PQQ C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00141 3-Methyl-2-oxobutanoicacid C00143 5,10-Methylenetetrahydrofolate C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00177 Cyanide C00178 Thymine C00179 Agmatine C00180 Benzoate C00181 D-Xylose C00183 L-Valine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00214 Thymidine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00234 10-Formyltetrahydrofolate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00244 Nitrate C00247 L-Sorbose C00250 Pyridoxal C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00255 Riboflavin C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00261 Benzaldehyde C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00268 Dihydrobiopterin C00270 N-Acetylneuraminate C00272 Tetrahydrobiopterin C00273 5-Dehydro-D-fructose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00282 Hydrogen C00286 dGTP C00288 HCO3- C00292 Aniline C00293 Glucose C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00302 Glutamate C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00314 Pyridoxine C00315 Spermidine C00322 2-Oxoadipate C00325 GDP-L-fucose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00363 dTDP C00364 dTMP C00365 dUMP C00366 Urate C00379 Xylitol C00380 Cytosine C00383 Malonate C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00402 D-Aspartate C00408 L-Pipecolate C00415 Dihydrofolate C00417 cis-Aconitate C00423 trans-Cinnamate C00424 S-Lactaldehyde C00425 Dehydroascorbate C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00431 5-Aminopentanoate C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00440 5-Methyltetrahydrofolate C00441 L-Aspartate4-semialdehyde C00445 5,10-Methenyltetrahydrofolate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00449 N6-L-1,3-Dicarboxypropyl-L-lysine C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00459 dTTP C00460 dUTP C00463 Indole C00466 Acetoin C00469 Ethanol C00472 p-Benzoquinone C00474 Ribitol C00475 Cytidine C00476 D-Lyxose C00479 Propanal C00483 Tyramine C00488 Formamide C00489 Glutarate C00490 Itaconate C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00504 Folate C00507 L-Rhamnose C00508 L-Ribulose C00511 Propenoate C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00522 R-Pantoate C00526 Deoxyuridine C00530 p-Benzenediol C00532 L-Arabitol C00533 Nitricoxide C00534 Pyridoxamine C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00547 L-Noradrenaline C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00556 Benzylalcohol C00558 D-Tagaturonate C00559 Deoxyadenosine C00561 Mandelonitrile C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00575 3',5'-CyclicAMP C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00583 Propane-1,2-diol C00587 3-Hydroxybenzoate C00596 2-Hydroxy-2,4-pentadienoate C00597 3-Phosphoglycerate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00612 N1-Acetylspermidine C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00627 Pyridoxinephosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00633 4-Hydroxybenzaldehyde C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00643 5-Hydroxy-L-tryptophan C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00647 Pyridoxaminephosphate C00650 4-Hydroxymandelonitrile C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00664 5-Formiminotetrahydrofolate C00665 beta-D-Fructose2,6-bisphosphate C00666 LL-2,6-Diaminoheptanedioate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00680 meso-2,6-Diaminoheptanedioate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00692 UDP-N-acetylmuramoyl-L-alanyl-D-glutamate C00697 Nitrogen C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00739 D-Lysine C00740 D-Serine C00741 Diacetyl C00755 4-Hydroxy-3-methoxy-benzaldehyde C00763 D-Proline C00770 L-Idonate C00780 3-2-Aminoethyl-1H-indol-5-ol C00785 Urocanate C00788 L-Adrenaline C00789 CDP-ribitol C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00795 D-Tagatose C00800 L-Gulonate C00802 Oxalureate C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00813 Barbiturate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00829 Naphthalene C00842 dTDP-glucose C00844 R-Prunasin C00846 3-Oxoadipate C00847 4-Pyridoxate C00857 Deamino-NAD+ C00860 L-Histidinol C00861 L-Rhamnulose C00864 Pantothenate C00870 4-Nitrophenol C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00906 5,6-Dihydrothymine C00921 Dihydropteroate C00922 2,3-Dimethylmaleate C00931 Porphobilinogen C00935 UDP-L-arabinose C00937 R-Lactaldehyde C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00955 Indole-3-ethanol C00956 L-2-Aminoadipate C00962 beta-D-Galactose C00966 2-Dehydropantoate C00969 3-Hydroxypropanal C00971 4-Pyridoxolactone C00975 Dihydroxyfumarate C00976 GDP-D-mannuronate C00977 L-Tryptophanamide C00986 1,3-Diaminopropane C00988 2-Phosphoglycolate C00989 4-Hydroxybutanoicacid C00990 5-Aminopentanamide C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01007 Reducedriboflavin C01010 Urea-1-carboxylate C01013 3-Hydroxypropanoate C01015 4-Hydroxy-L-proline C01019 6-Deoxy-L-galactose C01020 6-Hydroxynicotinate C01024 Hydroxymethylbilane C01026 N,N-Dimethylglycine C01028 N6-Hydroxy-L-lysine C01029 N8-Acetylspermidine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01050 UDP-N-acetylmuramate C01051 UroporphyrinogenIII C01053 R-4-Dehydropantoate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01062 5-Dehydro-D-gluconate C01068 D-Ribitol5-phosphate C01073 N-Acetyl-beta-alanine C01079 ProtoporphyrinogenIX C01083 alpha,alpha-Trehalose C01088 R-3,3-Dimethylmalate C01089 R-3-Hydroxybutanoate C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01099 L-Fuculose1-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01111 7,8-Dihydroxykynurenate C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01115 L-Galactono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01131 L-Rhamnulose1-phosphate C01133 N-Acetyl-D-glucosaminate C01142 3S-3,6-Diaminohexanoate C01146 2-Hydroxy-3-oxopropanoate C01151 D-Ribose1,5-bisphosphate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01161 3,4-Dihydroxyphenylacetate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01185 NicotinateD-ribonucleotide C01186 3S,5S-3,5-Diaminohexanoate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01198 3-2-Hydroxyphenylpropanoate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01207 3-3,4-Dihydroxyphenyllactate C01212 UDP-N-acetylmuramoyl-L-alanine C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01249 7,8-Dihydro-7,8-dihydroxykynurenate C01250 N-Acetyl-L-glutamate5-semialdehyde C01251 2-Hydroxybutane-1,2,4-tricarboxylate C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01258 1,2-Didehydropiperidine-2-carboxylate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01270 3-Hydroxy-2-methylpyridine-5-carboxylate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01294 1-Guanidino-1-deoxy-scyllo-inositol4-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01328 HO- C01346 dUDP C01352 FADH2 C01353 Carbonicacid C01358 NH4OH C01359 PQQH2 C01367 3'-AMP C01368 3'-UMP C01380 Ethyleneglycol C01384 Maleicacid C01394 Xylose C01401 Alanine C01405 Aspirin C01407 Benzene C01408 Benzoin C01417 Cyanate C01424 Gallate C01438 Methane C01444 Oxamate C01454 Toluate C01455 Toluene C01456 Tropate C01467 3-Cresol C01468 4-Cresol C01475 Allysine C01504 Indanone C01507 L-Iditol C01508 L-Lyxose C01537 Urethane C01542 o-Cresol C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01586 Hippurate C01594 Linamarin C01596 Maleamate C01602 Ornithine C01606 Phthalate C01613 Stachyose C01620 Threonate C01623 UDP-apiose C01659 Acrylamide C01667 Bacitracin C01672 Cadaverine C01674 Chitobiose C01680 D-Fuconate C01682 D-Nopaline C01685 D-Ribonate C01697 Galactitol C01710 Indan-1-ol C01717 4-Hydroxy-2-quinolinecarboxylicacid C01721 L-Fuculose C01727 Lumichrome C01732 Mesaconate C01742 Palatinose C01751 Resorcinol C01762 Xanthosine C01769 S-Acetoin C01772 trans-2-Hydroxycinnamate C01801 Deoxyribose C01818 Hyponitrite C01825 L-Galactose C01837 Nitroethane C01845 Propan-2-ol C01847 ReducedFMN C01855 Taxiphyllin C01877 4-Oxoproline C01879 5-Oxoproline C01888 Aminoacetone C01904 D-Arabitol C01929 L-Histidinal C01934 L-Rhamnonate C01982 R-Amygdalin C01983 R-Mandelate C01984 S-Mandelate C01987 2-Aminophenol C01988 2-Nitrophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C01998 Acrylonitrile C02013 Cellotetraose C02024 D-Mannuronate C02043 Indolelactate C02048 Laminaribiose C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02091 Ureidoglycine C02097 dTDP-galactose C02107 S,S-Tartaricacid C02115 2-Methylserine C02116 2-Nitropropane C02132 Acetylpyruvate C02137 alpha-Oxo-benzeneaceticacid C02161 Isophenoxazine C02167 Maleylpyruvate C02191 Protoporphyrin C02199 UDP-L-rhamnose C02207 beta-Alanopine C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02253 Benzoylagmatine C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02274 Dihydrocoumarin C02280 GDP-L-galactose C02294 Methylguanidine C02295 Methylitaconate C02305 Phosphocreatine C02330 UDP-L-iduronate C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02360 2-Hydroxyadipate C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02376 5-Methylcytosine C02385 AminoacidArg- C02405 Formylphosphate C02427 L-Homocitrulline C02431 L-Rhamnofuranose C02457 Propane-1,3-diol C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02499 2-Hydroxybiphenyl C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02652 5-Dehydroshikimate C02655 6-Acetyl-D-glucose C02657 6-Methylsalicylate C02659 Acetonecyanohydrin C02669 D-Galactono-1,5-lactone C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02721 N-Methyl-L-alanine C02726 N4-Phosphoagmatine C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02780 2,5-Didehydro-D-gluconate C02787 2-Methylpropanamine C02798 3-Phosphonopyruvate C02800 4,5-Dioxopentanoate C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02837 L-Lysine1,6-lactam C02876 Propanoylphosphate C02888 Sorbose1-phosphate C02895 Xylitol5-phosphate C02912 R-Propane-1,2-diol C02916 S-Norlaudanosoline C02917 S-Propane-1,2-diol C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02948 4-Hydroxyhexan-3-one C02964 D-Glucosyl-D-mannose C02977 GDP-6-deoxy-D-talose C02979 Glycerol2-phosphate C02985 L-Fucose1-phosphate C02991 L-Rhamnono-1,4-lactone C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C03003 N-Glucosylnicotinate C03004 N-Hydroxy-L-tyrosine C03012 Naphthalene-1,2-diol C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03034 dTDP-D-galacturonate C03044 R,R-Butane-2,3-diol C03046 S,S-Butane-2,3-diol C03047 1,4-Diguanidinobutane C03056 2,6-Dihydroxypyridine C03057 2-Carboxybenzaldehyde C03063 2-Oxohept-3-enedioate C03064 3-Dehydro-L-threonate C03065 3-Guanidinopropanoate C03067 3-Hydroxybenzaldehyde C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03087 5-Acetamidopentanoate C03088 5-Hydroxymethyluracil C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03107 D-Glucono-1,4-lactone C03117 GDP-6-deoxy-D-mannose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03150 N-Ribosylnicotinamide C03153 N5-Methyl-L-glutamine C03164 Phenanthrene-3,4-diol C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03187 dTDP-6-deoxy-L-talose C03194 R-1-Aminopropan-2-ol C03198 S-4-Hydroxymandelate C03203 1-Hydroxy-2-naphthoate C03204 10-Formyldihydrofolate C03210 2,2'-Iminodipropanoate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03239 6-Amino-2-oxohexanoate C03246 ADPribose2'-phosphate C03248 Acetylenedicarboxylate C03263 CoproporphyrinogenIII C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03273 5-Oxopentanoate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03287 L-Glutamyl5-phosphate C03289 L-xylo-Hexulonolactone C03290 L-threo-3-Phenylserine C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03296 N2-Succinyl-L-arginine C03319 dTDP-6-deoxy-L-mannose C03340 L-2,3-Dihydrodipicolinate C03341 2-Amino-4-oxopentanoicacid C03351 3-Hydroxybenzylalcohol C03360 4-Nitrophenylphosphate C03373 Aminoimidazoleribotide C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03393 4-Phospho-D-erythronate C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03410 N-Glycoloyl-neuraminate C03415 N2-Succinyl-L-ornithine C03440 cis-4-Hydroxy-D-proline C03442 dTDP-L-dihydrostreptose C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03479 5-Formyltetrahydrofolate C03483 Adenosinetetraphosphate C03492 D-4'-Phosphopantothenate C03493 D-4-Hydroxyphenylglycine C03495 Deoxy-5-methylcytidylate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03549 2-Hydroxycinnamate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03590 4-Hydroxyphenylglyoxylate C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03652 2R,3S-2,3-Dimethylmalate C03656 S-5-Amino-3-oxohexanoicacid C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03672 3-4-Hydroxyphenyllactate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03691 CMP-N-glycoloylneuraminate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03710 N-Benzyloxycarbonylglycine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03741 S-4-Amino-5-oxopentanoate C03742 S-4-Hydroxymandelonitrile C03750 2,6-Dioxo-6-phenylhexanoate C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03766 4-Hydroxyphenylacetonitrile C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03790 N-Carboxymethyl-D-alanine C03794 N6-1,2-Dicarboxyethyl-AMP C03817 S-3-Imidazol-5-yllactate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03871 L-2-Amino-6-oxoheptanedioate C03872 L-Serine-phosphoethanolamine C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03964 R-3-4-Hydroxyphenyllactate C03971 1F-alpha-D-Galactosylraffinose C03972 2,3,4,5-Tetrahydrodipicolinate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C03996 5'-O-beta-D-Glucosylpyridoxine C03997 5-Hydroxymethyldeoxycytidylate C04002 But-1-ene-1,2,4-tricarboxylate C04006 1D-myo-Inositol3-phosphate C04020 N2-D-1-Carboxyethyl-L-lysine C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04039 2,3-Dihydroxy-3-methylbutanoate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04053 5-Dehydro-4-deoxy-D-glucuronate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04076 L-2-Aminoadipate6-semialdehyde C04089 UDP-4-dehydro-6-deoxy-D-glucose C04091 cis-1,2-Dihydrobenzene-1,2-diol C04092 delta1-Piperideine-2-carboxylate C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04137 N2-D-1-Carboxyethyl-L-arginine C04138 Nalpha-gamma-L-Glutamylhistamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04187 5-Methyldeoxycytidinediphosphate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04210 N5-L-1-Carboxyethyl-L-ornithine C04211 N6-Indol-3-ylacetyl-L-lysine C04221 trans-1,2-Dihydrobenzene-1,2-diol C04225 Z-But-2-ene-1,2,3-tricarboxylate C04226 6-oxo-1,4,5,6-tetrahydronicotinate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04244 6-Lactoyl-5,6,7,8-tetrahydropterin C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04268 dTDP-4-amino-4,6-dideoxy-D-glucose C04272 R-2,3-Dihydroxy-3-methylbutanoate C04280 1-Guanidino-1-deoxy-scyllo-inositol C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04297 CDP-4-dehydro-3,6-dideoxy-D-glucose C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04314 cis-1,2-Dihydronaphthalene-1,2-diol C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04332 6,7-Dimethyl-8-1-D-ribityllumazine C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04353 Z-4-Hydroxyphenylacetaldehyde-oxime C04359 1-Deoxy-D-altro-heptulose7-phosphate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04437 1-5-Phosphoribosylimidazole-4-acetate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04454 5-Amino-6-5'-phosphoribitylaminouracil C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04462 N-Succinyl-2-L-amino-6-oxoheptanedioate C04468 +-cis-3,4-Dihydrophenanthrene-3,4-diol C04471 4S,5S-4,5-Dihydroxy-2,6-dioxohexanoate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04514 1S,2S-1,2-Dihydronaphthalene-1,2-diol C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04546 R-3-R-3-Hydroxybutanoyloxybutanoate C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04573 UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C04579 Inositol1,2,3,4,5-pentakisphosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04592 Toluene-cis-dihydrodiol C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04634 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04700 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine C04702 UDPMurAcoyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04732 4-1-D-Ribitylamino-5-amino-2,6-dihydroxypyrimidine C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04783 cis-4,5-Dihydroxycyclohexa-16,2-diene-1,2-dicarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04856 6S-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04877 UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate C04882 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05005 Glycolipid C05100 3-Ureidoisobutyrate C05114 Mucopolysaccharide C05130 Imidazole-4-acetaldehyde C05131 1-Ribosylimidazole-4-acetate C05133 4-Imidazolone-5-acetate C05143 Dhurrin C05145 3-Aminoisobutanoate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05161 2,5-Diaminohexanoate C05235 Hydroxyacetone C05239 5-Aminoimidazole C05328 D-2-Amino-hexano-6-lactam C05332 Phenethylamine C05340 beta-Alanyl-L-arginine C05341 beta-Alanyl-L-lysine C05343 R-4-Hydroxymandelate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05379 Oxalosuccinate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05385 D-Glucuronate1-phosphate C05394 3-Keto-beta-D-galactose C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05403 3-Ketolactose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05411 L-Xylonate C05412 L-Lyxonate C05422 L-Dehydroascorbate C05512 Deoxyinosine C05513 Urate-3-ribonucleoside C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05533 Oxaloglutarate C05539 N-Acetyl-L-2-amino-6-oxopimelate C05548 6-Acetamido-2-oxohexanoate C05560 L-2-Aminoadipateadenylate C05565 Hydantoin-5-propionate C05568 Imidazolelactate C05569 5'-Phospho-D-1-ribulosylformimine C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05576 3,4-Dihydroxyphenylethyleneglycol C05577 3,4-Dihydroxymandelaldehyde C05580 3,4-Dihydroxymandelate C05585 Gentisatealdehyde C05593 3-Hydroxyphenylacetate C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05607 Phenyllactate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05629 Phenylpropanoate C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05638 5-Hydroxykynurenamine C05639 4,6-Dihydroxyquinoline C05640 Cinnavalininate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05646 5-Hydroxyindolepyruvate C05647 Formyl-5-hydroxykynurenamine C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05654 5-2'-Formylethyl-4,6-dihydroxypicolinate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05656 5-3'-Carboxy-3'-oxopropyl-4,6-dihydroxypicolinate C05657 6-Hydroxyindolelactate C05658 Indoxyl C05662 Homoisocitrate C05665 beta-Aminopropionaldehyde C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05731 3-Ketosucrose C05765 L-Glutamyl1-phosphate C05766 UroporphyrinogenI C05768 CoproporphyrinogenI C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05820 L-Seryladenylate C05822 3'-CMP C05825 2-Amino-5-oxohexanoate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05838 cis-2-Hydroxycinnamate C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05840 Iminoaspartate C05841 NicotinateD-ribonucleoside C05851 Coumarin C05852 2-Hydroxyphenylacetate C05853 Phenylethylalcohol C05854 4-Carboxy-2-oxo-4-pentanoate C05892 UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05928 10-FormyltetrahydrofolylL-glutamate C05931 N-Succinyl-L-glutamate C05932 N-Succinyl-L-glutamate5-semialdehyde C05933 N-omega-Hydroxyarginine C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05938 L-4-Hydroxyglutamatesemialdehyde C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05979 Propane-1-ol C05983 Propinoladenylate C05984 2-Hydroxybutanoicacid C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C05993 Acetyladenylate C05999 Lactaldehyde C06010 S-2-Acetolactate C06016 Pentosans C06017 dTDP-D-glucuronate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06044 4-Hydroxyphenylethanol C06046 Salidroside C06047 Stizolobate C06048 Stizolobinate C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal C06054 2-Oxo-3-hydroxy-4-phosphobutanoate C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol C06059 Cyclicamidines C06114 gamma-Glutamyl-beta-aminopropiononitrile C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06156 alpha-D-Glucosamine1-phosphate C06159 2-Dehydro-3-deoxy-D-fuconate C06160 S-Norcoclaurine C06180 Anabasine C06181 Piperideine C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06202 Salicylaldehyde C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06205 1,2-Dihydronaphthalene-1,2-diol C06206 Benzoylphosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06240 UDP-N-acetyl-D-mannosaminouronate C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06311 Galactitol1-phosphate C06312 L-Tagatose6-phosphate C06313 Biopterin C06316 D-erythro-Ascorbate C06317 4-Hydroxy-3-methoxy-benzenemethanol C06318 3S,4R-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate C06321 1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylicacid C06330 Quinoline-3,4-diol C06337 Terephthalate C06343 Quinolin-4-ol C06358 Methylcinnamate C06359 Ethylcinnamate C06360 Propylcinnamate C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06430 D-Galacturonolactone C06432 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanine C06433 5'-Benzoylphosphoadenosine C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06547 Ethylene C06548 Ethyleneoxide C06554 Cyanuricacid C06555 Biuret C06588 Biphenyl C06589 cis-2,3-Dihydro-2,3-dihydroxybiphenyl C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06672 Vanillate C06680 4-Hydroxyphthalate C06701 Phosphonate C06711 Fluoren-9-ol C06712 Fluoren-9-one C06720 1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate C06727 cis-1,2-Dihydro-3-ethylcatechol C06728 3-Ethylcatechol C06729 cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate C06730 4-Methylcatechol C06731 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate C06732 alpha,beta-Didehydrotryptophan C06735 Aminoacetaldehyde C06746 N-Acetylphenylethylamine C06756 p-Xylene C06757 4-Methylbenzylalcohol C06758 p-Tolualdehyde C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06876 Nitrosobenzene C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C06986 Spirodilactone C07024 3'-Keto-3'-deoxy-ATP C07025 3'-Keto-3'-deoxy-AMP C07083 Styrene C07084 Styrenecis-glycol C07085 3-Vinylcatechol C07086 Phenylaceticacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07111 Ethylbenzene C07112 1-Phenylethanol C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07130 Theophylline C07208 m-Xylene C07209 3-Methylbenzaldehyde C07211 m-Methylbenzoate C07212 o-Xylene C07213 2-Methylbenzylalcohol C07214 2-Methylbenzaldehyde C07215 o-Toluate C07216 3-Methylbenzylalcohol C07272 Maleimide C07277 dTDP-D-fucose C07301 R-Mandelamide C07305 ProductsofATPbreakdown C07335 2-Amino-3-oxo-4-phosphonooxybutyrate C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07480 Theobromine C07481 Caffeine C07715 Fluorene C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07719 2-Formyl-1-indanone C07720 3-Hydroxy-1-indanone C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07726 1-Formyl-2-indanone C07729 Dibenzofuran C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07732 Dibenzo-p-dioxin C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08060 Carbazole C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08481 Indican C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C09332 Tetrahydrofolyl-Glu2 C09814 Benzonitrile C09815 Benzamide C09816 Benzylsuccinate C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C10700 4'-Hydroxyacetophenone C10906 D-Fructose C11038 2'-Deoxy-5-hydroxymethylcytidine-5'-diphosphate C11039 2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate C11130 3-Hydroxyindolin-2-one C11174 1-Diphosinositolpentakisphosphate C11348 S-1-Phenylethanol C11354 2-Hydroxy-cis-hex-2,4-dienoate C11355 4-Amino-4-deoxychorismate C11422 Phenanthracene C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C11427 1-Hydroxy-2-naphthaldehyde C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol C11434 2-C-Methyl-D-erythritol4-phosphate C11435 4-Cytidine5'-diphospho-2-C-methyl-D-erythritol C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11437 1-Deoxy-D-xylulose5-phosphate C11453 2-C-Methyl-D-erythritol2,4-cyclodiphosphate C11457 3-3-Hydroxy-phenyl-propanoicacid C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11588 cis-3-Carboxy-ethyl-3,5-cyclo-hexadiene-1,2-diol C11631 9-Riburonosylhypoxanthine C11638 3-Amino-2-oxopropylphosphate C11713 beta-Naphthol C11714 alpha-Naphthol C11821 5-Hydroxyisourate C11822 2-Aminomalonatesemialdehyde C11824 Cyclicamide C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11920 dTDP-L-olivose C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose C11925 dTDP-3-amino-3,6-dideoxy-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose C12210 UDP-3-ketoglucose C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12312 Indolin-2-one C12318 dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose C12323 L-4-Hydroxyphenylglycine C12455 5-Aminopentanal C12621 trans-3-Hydroxycinnamate C12622 cis-3-3-Carboxyethenyl-3,5-cyclohexadiene-1,2-diol C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C12986 N2-Acetyl-L-aminoadipate C12987 N2-Acetyl-L-aminoadipyl-delta-phosphate C12988 N2-Acetyl-L-aminoadipatesemialdehyde C12989 N2-Acetyl-L-lysine C13624 BisphenolA C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene C13633 2,2-Bis4-hydroxyphenyl-propanoicacid C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13637 4-Ethylphenol C13638 1-4'-Hydroxyphenylethanol C13747 1,7-Dimethylxanthine C13952 UDP-N-acetyl-D-galactosaminuronicacid C14082 1-Methylnaphthalene C14083 cis-1,2-Dihydroxy-1,2-dihydro-8-methylnaphthalene C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14087 3-Methylsalicylaldehyde C14088 3-Methylsalicylate C14089 1-Hydroxymethylnaphthalene C14090 1-Naphthaldehyde C14091 1-Naphthoicacid C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14103 4-Methylsalicylate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14783 1,2-Naphthoquinone C14784 1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15483 D-Galactonolactone C15499 Pentane-2,4-dione C15503 N,N-Dihydroxy-L-tyrosine C15522 4a-Hydroxytetrahydrobiopterin C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15585 myo-Inositolphosphate C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15607 3-Oxo-3-ureidopropanoate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15769 HBOA C15770 DIBOA C15772 DIBOA-glucoside C15809 Iminoglycine C15853 Dehydrospermidine C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15930 L-Galactonate C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16071 Riboflavincyclic-4',5'-phosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16153 UDP-L-Ara4N C16154 UDP-L-Ara4FN C16155 UDP-L-Ara4O C16159 2-Formylglutarate C16186 L-Ascorbate6-phosphate C16215 1,2-Dihydrophthalicacid C16234 o-Nitrobenzoate C16235 o-Hydroxylaminobenzoate C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16352 7-Methylxanthosine C16353 7-Methylxanthine C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16357 3-Methylxanthine C16358 1-Methylxanthine C16359 1-Methyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 4 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00058 Formate C00067 Formaldehyde C00080 H+ C00085 D-Fructose6-phosphate C00089 Sucrose C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00132 Methanol C00137 myo-Inositol C00159 D-Mannose C00184 Glycerone C00185 Cellobiose C00191 D-Glucuronate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00227 Acetylphosphate C00231 D-Xylulose5-phosphate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00447 D-Sedoheptulose1,7-bisphosphate C00514 D-Mannonate C00536 Triphosphate C00546 Methylglyoxal C00577 D-Glyceraldehyde C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00629 2-Dehydro-D-gluconate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00905 D-Fructuronate C00969 3-Hydroxypropanal C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01742 Palatinose C02013 Cellotetraose C02048 Laminaribiose C02336 beta-D-Fructose C02466 Trimetaphosphate C02591 Sucrose6-phosphate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03546 myo-Inositol4-phosphate C03661 1F-beta-D-Fructosylsucrose C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05682 Phosphonoacetate C05999 Lactaldehyde C06019 D-arabino-3-Hexulose6-phosphate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone C07836 D-glycero-D-manno-Heptose7-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15585 myo-Inositolphosphate Consensus scope of cluster 5 C00001 H2O C00007 Oxygen C00027 H2O2 C00031 D-Glucose C00080 H+ C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 6 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00704 O2.- C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Consensus scope of cluster 7 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00022 Pyruvate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00067 Formaldehyde C00074 Phosphoenolpyruvate C00080 H+ C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00121 D-Ribose C00122 Fumarate C00132 Methanol C00137 myo-Inositol C00149 S-Malate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00216 D-Arabinose C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00252 Isomaltose C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00309 D-Ribulose C00311 Isocitrate C00345 6-Phospho-D-gluconate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00447 D-Sedoheptulose1,7-bisphosphate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00514 D-Mannonate C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00552 meso-Tartaricacid C00577 D-Glyceraldehyde C00596 2-Hydroxy-2,4-pentadienoate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00636 D-Mannose1-phosphate C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00711 Malate C00794 D-Sorbitol C00804 Propynoate C00810 R-Acetoin C00817 D-Altronate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00944 3-Dehydroquinate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01108 1,2,3-Trihydroxybenzene C01112 D-Arabinose5-phosphate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02266 D-Xylonolactone C02336 beta-D-Fructose C02341 trans-Aconitate C02351 1,2-Benzoquinone C02466 Trimetaphosphate C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02591 Sucrose6-phosphate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02753 D-Xylono-1,4-lactone C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03167 Phosphonoacetaldehyde C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03716 Oxaloacetate4-methylester C03736 alpha-D-Ribose5-phosphate C03765 4-Hydroxyphenylacetaldehyde C03785 D-Tagatose1,6-bisphosphate C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03947 Glycerol1,2-cyclicphosphate C03981 2-Hydroxyethylenedicarboxylate C04006 1D-myo-Inositol3-phosphate C04044 3-2,3-Dihydroxyphenylpropanoate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05616 3-O-Methylgallate C05682 Phosphonoacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06187 Arbutin6-phosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06316 D-erythro-Ascorbate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07103 2-Hydroxy-1,4-benzoquinone C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C11437 1-Deoxy-D-xylulose5-phosphate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14899 3-Dehydro-L-gulonate6-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15585 myo-Inositolphosphate C16186 L-Ascorbate6-phosphate Consensus scope of cluster 8 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 9 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00022 Pyruvate C00024 Acetyl-CoA C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00083 Malonyl-CoA C00084 Acetaldehyde C00090 Catechol C00091 Succinyl-CoA C00100 Propanoyl-CoA C00109 2-Oxobutanoate C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00313 Oxalyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00383 Malonate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00511 Propenoate C00530 p-Benzenediol C00531 Itaconyl-CoA C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00566 3S-Citryl-CoA C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00798 Formyl-CoA C00804 Propynoate C00810 R-Acetoin C00815 Citramalate C00818 D-Glucarate C00827 Lactoyl-CoA C00846 3-Oxoadipate C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00904 Citramalyl-CoA C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C00989 4-Hydroxybutanoicacid C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01213 R-2-Methyl-3-oxopropanoyl-CoA C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01757 Triacetate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02170 Methylmalonate C02214 E-Glutaconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02266 D-Xylonolactone C02295 Methylitaconate C02331 Vinylacetyl-CoA C02341 trans-Aconitate C02351 1,2-Benzoquinone C02411 Glutaconyl-1-CoA C02480 cis,cis-Muconate C02488 R-2-Ethylmalate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02557 Methylmalonyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C03058 2-Hydroxyglutaryl-CoA C03223 3,4-Dihydroxyphthalate C03231 3-Methylglutaconyl-CoA C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03344 2-Methylacetoacetyl-CoA C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03561 R-3-Hydroxybutanoyl-CoA C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05116 3-Hydroxybutanoyl-CoA C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05668 3-Hydroxypropionyl-CoA C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06002 S-Methylmalonatesemialdehyde C06010 S-2-Acetolactate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06719 Dihydrophloroglucinol C06728 3-Ethylcatechol C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11062 4-Hydroxybutyryl-CoA C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16268 Cyclopropanecarboxyl-CoA C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 10 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- C05421 15-cis-Phytoene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15892 Chloroxanthin C15898 Demethylspheroidene C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16276 epsilon-Carotene Consensus scope of cluster 11 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00704 O2.- C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose Consensus scope of cluster 12 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00080 H+ C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00282 Hydrogen C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C00521 --Limonene C00536 Triphosphate C00704 O2.- C01230 all-trans-Hexaprenyldiphosphate C01390 Prenol C01414 Casbene C01841 Pentalenene C01860 Trichodiene C02004 Aristolochene C02344 --endo-Fenchol C02462 Sabinenehydrate C02466 Trimetaphosphate C02569 Neryldiphosphate C03190 +-Bornyl-diphosphate C03427 Prephytoenediphosphate C03428 Presqualenediphosphate C04216 all-trans-Heptaprenyldiphosphate C04217 all-trans-Pentaprenyldiphosphate C04509 di-trans,poly-cis-Decaprenyldiphosphate C04574 di-trans,poly-cis-Undecaprenyldiphosphate C05359 e- C05413 Phytoene C05414 Phytofluene C05421 15-cis-Phytoene C05430 zeta-Carotene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C06074 Myrcene C06075 Terpinolene C06076 Comphene C06077 Pinene C06086 Pimaradiene C06089 ent-Copalyldiphosphate C06090 ent-Kaurene C06099 +-Limonene C06111 Nerolidyldiphosphate C06307 --beta-Pinene C06308 --alpha-Pinene C06394 +-delta-Cadinene C08586 delta-Carotene C11356 trans,trans,cis-Geranylgeranyldiphosphate C11388 --Linalool C11389 +-Linalool C11877 +-Sandaracopimaradiene C11878 --Abietadiene C11879 Levopimaradiene C11880 Neoabietadiene C11881 Palustradiene C11894 Taxa-45,1112-diene C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate C12142 Vetispiradiene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15892 Chloroxanthin C15898 Demethylspheroidene C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16028 Amorpha-4,11-diene C16141 +-GermacreneA C16142 --GermacreneD C16143 1E,4S,5E,7R-Germacra-110,5-dien-11-ol C16269 epi-Isozizaene C16276 epsilon-Carotene Consensus scope of cluster 13 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15791 Teasterone C15792 3-Dehydroteasterone C15793 Typhasterol C15794 Castasterone C15797 22alpha-Hydroxy-5alpha-campestan-3-one C15798 6-Deoxocathasterone C15799 6-Deoxoteasterone C15800 3-Dehydro-6-deoxoteasterone C15801 6-Deoxotyphasterol C15802 6-Deoxocastasterone C15803 6alpha-Hydroxy-castasterone Consensus scope of cluster 14 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03309 Strictosidineaglycone C03677 4,21-Dehydrogeissoschizine C09107 Catharanthine C09244 Tabersonine C11678 Dialdehyde C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Consensus scope of cluster 15 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00472 p-Benzoquinone C00530 p-Benzenediol C00704 O2.- C02222 2-Maleylacetate C02814 Benzene-1,2,4-triol C03676 3-Hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C12838 trans-4-Carboxymethylenebut-2-en-4-olide Consensus scope of cluster 16 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00072 Ascorbate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00425 Dehydroascorbate C00704 O2.- C00800 L-Gulonate C00975 Dihydroxyfumarate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01115 L-Galactono-1,4-lactone C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01620 Threonate C03289 L-xylo-Hexulonolactone C03459 2-Hydroxy-3-oxosuccinate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05411 L-Xylonate C05412 L-Lyxonate C05422 L-Dehydroascorbate C15930 L-Galactonate Consensus scope of cluster 17 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01226 12-OPDA C04594 9Z-13S-12,13-Epoxyoctadeca-9,11-dienoicacid C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C06427 9Z,12Z,15Z-Octadecatrienoicacid C16309 Traumatin C16310 3-Hexenal C16311 12-Oxo-9Z-dodecenoicacid C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16322 9-Oxononanoicacid C16323 3,6-Nonadienal C16324 9,10-EOT C16325 10-OPDA Consensus scope of cluster 18 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01054 S-2,3-Epoxysqualene C01724 Lanosterol C01902 Cycloartenol C06085 Triterpenoid C08615 alpha-Amyrin C08616 beta-Amyrin C08628 Lupeol C08980 SoyasapogenolB Consensus scope of cluster 19 C00001 H2O C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00007 Oxygen C00008 ADP C00009 Orthophosphate C00010 CoA C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00016 FAD C00018 Pyridoxalphosphate C00019 S-Adenosyl-L-methionine C00020 AMP C00021 S-Adenosyl-L-homocysteine C00022 Pyruvate C00024 Acetyl-CoA C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00047 L-Lysine C00048 Glyoxylate C00049 L-Aspartate C00051 Glutathione C00052 UDP-D-galactose C00053 3'-Phosphoadenylylsulfate C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00059 Sulfate C00061 FMN C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00072 Ascorbate C00073 L-Methionine C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00083 Malonyl-CoA C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00087 Sulfur C00088 Nitrite C00089 Sucrose C00090 Catechol C00091 Succinyl-CoA C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00094 Sulfite C00095 D-Fructose C00096 GDP-mannose C00097 L-Cysteine C00099 beta-Alanine C00100 Propanoyl-CoA C00101 Tetrahydrofolate C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00113 PQQ C00114 Choline C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00120 Biotin C00121 D-Ribose C00122 Fumarate C00123 L-Leucine C00124 D-Galactose C00127 Glutathionedisulfide C00128 CMP-N-acetylneuraminate C00129 Isopentenyldiphosphate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00136 Butanoyl-CoA C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00141 3-Methyl-2-oxobutanoicacid C00143 5,10-Methylenetetrahydrofolate C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00154 Palmitoyl-CoA C00155 L-Homocysteine C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00170 5'-Methylthioadenosine C00177 Cyanide C00178 Thymine C00179 Agmatine C00180 Benzoate C00181 D-Xylose C00183 L-Valine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00214 Thymidine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00223 p-Coumaroyl-CoA C00224 Adenylylsulfate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00233 4-Methyl-2-oxopentanoate C00234 10-Formyltetrahydrofolate C00235 Dimethylallyldiphosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00244 Nitrate C00245 Taurine C00246 Butanoicacid C00247 L-Sorbose C00249 Hexadecanoicacid C00250 Pyridoxal C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00255 Riboflavin C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00261 Benzaldehyde C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00268 Dihydrobiopterin C00270 N-Acetylneuraminate C00272 Tetrahydrobiopterin C00273 5-Dehydro-D-fructose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00282 Hydrogen C00283 Hydrogensulfide C00286 dGTP C00288 HCO3- C00292 Aniline C00293 Glucose C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00302 Glutamate C00307 CDP-choline C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00313 Oxalyl-CoA C00314 Pyridoxine C00315 Spermidine C00319 Sphingosine C00320 Thiosulfate C00322 2-Oxoadipate C00323 Caffeoyl-CoA C00325 GDP-L-fucose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00332 Acetoacetyl-CoA C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00341 Geranyldiphosphate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00349 2-Methyl-3-oxopropanoate C00352 D-Glucosamine6-phosphate C00353 Geranylgeranyldiphosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00363 dTDP C00364 dTMP C00365 dUMP C00366 Urate C00379 Xylitol C00380 Cytosine C00383 Malonate C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00389 Quercetin C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00400 --Menthol C00402 D-Aspartate C00406 Feruloyl-CoA C00407 L-Isoleucine C00408 L-Pipecolate C00409 Methanethiol C00411 Sinapoyl-CoA C00412 Stearoyl-CoA C00414 Cyclohexanone C00415 Dihydrofolate C00417 cis-Aconitate C00418 R-Mevalonate C00423 trans-Cinnamate C00424 S-Lactaldehyde C00425 Dehydroascorbate C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00431 5-Aminopentanoate C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00440 5-Methyltetrahydrofolate C00441 L-Aspartate4-semialdehyde C00445 5,10-Methenyltetrahydrofolate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00448 trans,trans-Farnesyldiphosphate C00449 N6-L-1,3-Dicarboxypropyl-L-lysine C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00459 dTTP C00460 dUTP C00463 Indole C00466 Acetoin C00469 Ethanol C00472 p-Benzoquinone C00474 Ribitol C00475 Cytidine C00476 D-Lyxose C00479 Propanal C00482 Sinapate C00483 Tyramine C00488 Formamide C00489 Glutarate C00490 Itaconate C00491 L-Cystine C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00504 Folate C00506 L-Cysteate C00507 L-Rhamnose C00508 L-Ribulose C00509 Naringenin C00511 Propenoate C00512 S-BenzoatecoenzymeA C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00517 Hexadecanal C00519 Hypotaurine C00521 --Limonene C00522 R-Pantoate C00526 Deoxyuridine C00527 Glutaryl-CoA C00530 p-Benzenediol C00531 Itaconyl-CoA C00532 L-Arabitol C00533 Nitricoxide C00534 Pyridoxamine C00536 Triphosphate C00540 Cinnamoyl-CoA C00542 Cystathionine C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00547 L-Noradrenaline C00548 Phenylacetate C00552 meso-Tartaricacid C00553 +-Neomenthol C00555 4-Aminobutanal C00556 Benzylalcohol C00558 D-Tagaturonate C00559 Deoxyadenosine C00561 Mandelonitrile C00566 3S-Citryl-CoA C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00571 Cyclohexylamine C00575 3',5'-CyclicAMP C00576 Betainealdehyde C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00582 Phenylacetyl-CoA C00583 Propane-1,2-diol C00587 3-Hydroxybenzoate C00588 Cholinephosphate C00590 Coniferylalcohol C00593 Sulfoacetaldehyde C00596 2-Hydroxy-2,4-pentadienoate C00597 3-Phosphoglycerate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00611 N-Acetyllactosamine C00612 N1-Acetylspermidine C00616 Quercetin3-sulfate C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00627 Pyridoxinephosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00630 2-Methylpropanoyl-CoA C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00633 4-Hydroxybenzaldehyde C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00643 5-Hydroxy-L-tryptophan C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00647 Pyridoxaminephosphate C00650 4-Hydroxymandelonitrile C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00664 5-Formiminotetrahydrofolate C00665 beta-D-Fructose2,6-bisphosphate C00666 LL-2,6-Diaminoheptanedioate C00668 alpha-D-Glucose6-phosphate C00669 gamma-L-Glutamyl-L-cysteine C00670 sn-glycero-3-Phosphocholine C00671 S-3-Methyl-2-oxopentanoicacid C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00680 meso-2,6-Diaminoheptanedioate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00692 UDP-N-acetylmuramoyl-L-alanyl-D-glutamate C00697 Nitrogen C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00719 Betaine C00736 Cysteine C00739 D-Lysine C00740 D-Serine C00741 Diacetyl C00745 Nicotine C00750 Spermine C00751 Squalene C00755 4-Hydroxy-3-methoxy-benzaldehyde C00757 Berberine C00761 Coniferin C00763 D-Proline C00770 L-Idonate C00772 Mevaldate C00780 3-2-Aminoethyl-1H-indol-5-ol C00785 Urocanate C00786 --Vestitone C00788 L-Adrenaline C00789 CDP-ribitol C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00794 D-Sorbitol C00795 D-Tagatose C00798 Formyl-CoA C00800 L-Gulonate C00802 Oxalureate C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00813 Barbiturate C00814 BiochaninA C00815 Citramalate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00823 1-Hexadecanol C00826 L-Arogenate C00827 Lactoyl-CoA C00829 Naphthalene C00831 Pantetheine C00836 Sphinganine C00842 dTDP-glucose C00843 --Menthone C00844 R-Prunasin C00846 3-Oxoadipate C00847 4-Pyridoxate C00852 Chlorogenate C00854 Cyclohexanol C00855 D-Methionine C00857 Deamino-NAD+ C00858 Formononetin C00860 L-Histidinol C00861 L-Rhamnulose C00864 Pantothenate C00870 4-Nitrophenol C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00882 Dephospho-CoA C00884 Homocarnosine C00885 Isochorismate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00903 Cinnamaldehyde C00904 Citramalyl-CoA C00905 D-Fructuronate C00906 5,6-Dihydrothymine C00916 CephalosporinC C00919 Cholinesulfate C00920 CoA-glutathione C00921 Dihydropteroate C00922 2,3-Dimethylmaleate C00928 Mercaptoethanol C00931 Porphobilinogen C00933 Sinapoylcholine C00935 UDP-L-arabinose C00937 R-Lactaldehyde C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00955 Indole-3-ethanol C00956 L-2-Aminoadipate C00957 Mercaptopyruvate C00962 beta-D-Galactose C00964 --trans-Carveol C00966 2-Dehydropantoate C00969 3-Hydroxypropanal C00971 4-Pyridoxolactone C00974 Dihydrokaempferol C00975 Dihydroxyfumarate C00976 GDP-D-mannuronate C00977 L-Tryptophanamide C00978 N-Acetylserotonin C00979 O-Acetyl-L-serine C00986 1,3-Diaminopropane C00988 2-Phosphoglycolate C00989 4-Hydroxybutanoicacid C00990 5-Aminopentanamide C00993 D-Alanyl-D-alanine C01004 N-Methylnicotinate C01005 O-Phospho-L-serine C01007 Reducedriboflavin C01010 Urea-1-carboxylate C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01015 4-Hydroxy-L-proline C01019 6-Deoxy-L-galactose C01020 6-Hydroxynicotinate C01024 Hydroxymethylbilane C01026 N,N-Dimethylglycine C01028 N6-Hydroxy-L-lysine C01029 N8-Acetylspermidine C01031 S-Formylglutathione C01033 2-Methylbutanoyl-CoA C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01037 7,8-Diaminononanoate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01050 UDP-N-acetylmuramate C01051 UroporphyrinogenIII C01053 R-4-Dehydropantoate C01054 S-2,3-Epoxysqualene C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01062 5-Dehydro-D-gluconate C01063 6-Carboxyhexanoyl-CoA C01068 D-Ribitol5-phosphate C01073 N-Acetyl-beta-alanine C01075 N-Sulfo-D-glucosamine C01077 O-Acetyl-L-homoserine C01079 ProtoporphyrinogenIX C01083 alpha,alpha-Trehalose C01088 R-3,3-Dimethylmalate C01089 R-3-Hydroxybutanoate C01092 8-Amino-7-oxononanoate C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01099 L-Fuculose1-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01107 R-5-Phosphomevalonate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01111 7,8-Dihydroxykynurenate C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01115 L-Galactono-1,4-lactone C01118 O-Succinyl-L-homoserine C01120 Sphinganine1-phosphate C01123 --trans-Isopiperitenol C01127 4-Hydroxy-2-oxoglutarate C01131 L-Rhamnulose1-phosphate C01133 N-Acetyl-D-glucosaminate C01134 Pantetheine4'-phosphate C01137 S-Adenosylmethioninamine C01142 3S-3,6-Diaminohexanoate C01143 R-5-Diphosphomevalonate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01147 2-Hydroxycyclohexan-1-one C01151 D-Ribose1,5-bisphosphate C01152 Npi-Methyl-L-histidine C01155 Quercetin3,3'-bissulfate C01156 Quercetin3,4'-bissulfate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01161 3,4-Dihydroxyphenylacetate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01175 1-O-Sinapoyl-beta-D-glucose C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01180 4-Methylthio-2-oxobutanoicacid C01182 D-Ribulose1,5-bisphosphate C01185 NicotinateD-ribonucleotide C01186 3S,5S-3,5-Diaminohexanoate C01187 3-Deoxy-D-manno-octulosonate C01188 3-Hydroxy-2-methylpropanoate C01197 3,4-Dihydroxy-trans-cinnamate C01198 3-2-Hydroxyphenylpropanoate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01205 R-3-Amino-2-methylpropanoate C01207 3-3,4-Dihydroxyphenyllactate C01210 N-Methylethanolaminephosphate C01212 UDP-N-acetylmuramoyl-L-alanine C01213 R-2-Methyl-3-oxopropanoyl-CoA C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01230 all-trans-Hexaprenyldiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01249 7,8-Dihydro-7,8-dihydroxykynurenate C01250 N-Acetyl-L-glutamate5-semialdehyde C01251 2-Hydroxybutane-1,2,4-tricarboxylate C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01255 N-6-Aminohexanoyl-6-aminohexanoate C01258 1,2-Didehydropiperidine-2-carboxylate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01262 beta-Alanyl-Npi-methyl-L-histidine C01263 6aS,11aS-3,6a,9-Trihydroxypterocarpan C01265 3',4',5-Trihydroxy-3,7-dimethoxyflavone C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01270 3-Hydroxy-2-methylpyridine-5-carboxylate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01294 1-Guanidino-1-deoxy-scyllo-inositol4-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01328 HO- C01346 dUDP C01352 FADH2 C01353 Carbonicacid C01358 NH4OH C01359 PQQH2 C01367 3'-AMP C01368 3'-UMP C01378 Fustin C01380 Ethyleneglycol C01384 Maleicacid C01390 Prenol C01394 Xylose C01401 Alanine C01403 Anisole C01405 Aspirin C01407 Benzene C01408 Benzoin C01412 Butanal C01414 Casbene C01417 Cyanate C01419 Cys-Gly C01420 Cystine C01424 Gallate C01438 Methane C01444 Oxamate C01454 Toluate C01455 Toluene C01456 Tropate C01467 3-Cresol C01468 4-Cresol C01470 Acacetin C01475 Allysine C01477 Apigenin C01481 Caffeate C01494 Ferulate C01502 o-Methoxyphenol C01504 Indanone C01507 L-Iditol C01508 L-Lyxose C01514 Luteolin C01527 Scopolin C01533 Syringin C01537 Urethane C01542 o-Cresol C01548 Acetylene C01551 Allantoin C01562 Calycosin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01586 Hippurate C01592 Licodione C01594 Linamarin C01596 Maleamate C01598 Melatonin C01602 Ornithine C01606 Phthalate C01613 Stachyose C01616 Tauropine C01617 Taxifolin C01620 Threonate C01623 UDP-apiose C01659 Acrylamide C01667 Bacitracin C01672 Cadaverine C01674 Chitobiose C01678 Cysteamine C01680 D-Fuconate C01682 D-Nopaline C01685 D-Ribonate C01697 Galactitol C01701 --GlyceollinI C01710 Indan-1-ol C01717 4-Hydroxy-2-quinolinecarboxylicacid C01721 L-Fuculose C01724 Lanosterol C01727 Lumichrome C01732 Mesaconate C01742 Palatinose C01745 Pinosylvin C01747 Psychosine C01750 Quercitrin C01751 Resorcinol C01752 Scopoletin C01755 Thiocyanate C01757 Triacetate C01762 Xanthosine C01767 --Carvone C01769 S-Acetoin C01771 2-Butenoate C01772 trans-2-Hydroxycinnamate C01795 Columbamine C01801 Deoxyribose C01817 Homocystine C01818 Hyponitrite C01825 L-Galactose C01832 Lauroyl-CoA C01837 Nitroethane C01841 Pentalenene C01845 Propan-2-ol C01847 ReducedFMN C01850 Rosmarinate C01855 Taxiphyllin C01857 Thioacetate C01860 Trichodiene C01861 Trithionate C01866 beta-Lactam C01877 4-Oxoproline C01879 5-Oxoproline C01880 6-Hexanolide C01888 Aminoacetone C01893 Biotinamide C01894 Biotinyl-CoA C01902 Cycloartenol C01904 D-Arabitol C01909 Dethiobiotin C01929 L-Histidinal C01934 L-Rhamnonate C01944 Octanoyl-CoA C01948 Pentadecanal C01962 Thiocysteine C01982 R-Amygdalin C01983 R-Mandelate C01984 S-Mandelate C01987 2-Aminophenol C01988 2-Nitrophenol C01989 3-Ethylmalate C01990 3-Oxalomalate C01993 5'-Oxoinosine C01996 Acetylcholine C01998 Acrylonitrile C02004 Aristolochene C02013 Cellotetraose C02015 CoA-disulfide C02024 D-Mannuronate C02041 Eicosanoyl-CoA C02043 Indolelactate C02048 Laminaribiose C02059 Phylloquinone C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02090 Trypanothione C02091 Ureidoglycine C02097 dTDP-galactose C02105 S-Reticuline C02106 S-Scoulerine C02107 S,S-Tartaricacid C02115 2-Methylserine C02116 2-Nitropropane C02130 Acetyl-maltose C02132 Acetylpyruvate C02137 alpha-Oxo-benzeneaceticacid C02161 Isophenoxazine C02167 Maleylpyruvate C02170 Methylmalonate C02183 Phloroglucinol C02191 Protoporphyrin C02199 UDP-L-rhamnose C02207 beta-Alanopine C02214 E-Glutaconate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02223 2-Methylbutanal C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02235 4-Nitrocatechol C02236 4-Sulfobenzoate C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02247 Anthranilyl-CoA C02253 Benzoylagmatine C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02274 Dihydrocoumarin C02280 GDP-L-galactose C02291 L-Cystathionine C02294 Methylguanidine C02295 Methylitaconate C02305 Phosphocreatine C02325 Sinapylalcohol C02330 UDP-L-iduronate C02331 Vinylacetyl-CoA C02335 beta-Alanyl-CoA C02336 beta-D-Fructose C02341 trans-Aconitate C02344 --endo-Fenchol C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02360 2-Hydroxyadipate C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02376 5-Methylcytosine C02378 6-Aminohexanoate C02385 AminoacidArg- C02394 Cinnamylalcohol C02405 Formylphosphate C02411 Glutaconyl-1-CoA C02427 L-Homocitrulline C02431 L-Rhamnofuranose C02442 N-Methyltyramine C02452 Perillylalcohol C02457 Propane-1,3-diol C02462 Sabinenehydrate C02463 Precorrin2 C02466 Trimetaphosphate C02469 UroporphyrinIII C02470 Xanthurenicacid C02477 alpha-Tocopherol C02480 cis,cis-Muconate C02483 gamma-Tocopherol C02485 --Isopiperitenone C02486 3R-beta-Leucine C02488 R-2-Ethylmalate C02495 2'-Hydroxydaidzein C02499 2-Hydroxybiphenyl C02501 2-Hydroxymuconate C02504 2S-2-Isopropylmalate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02527 Butanoylphosphate C02532 D-O-Phosphoserine C02557 Methylmalonyl-CoA C02558 N-Acetylarylamine C02564 N-Feruloylglycine C02565 N-Methylhydantoin C02569 Neryldiphosphate C02572 O-Feruloylquinate C02576 Perillylaldehyde C02587 Pyrimidodiazepine C02591 Sucrose6-phosphate C02593 Tetradecanoyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02631 2-Isopropylmaleate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02646 4-Coumarylalcohol C02647 4-Guanidinobutanal C02652 5-Dehydroshikimate C02655 6-Acetyl-D-glucose C02656 6-Carboxyhexanoate C02657 6-Methylsalicylate C02659 Acetonecyanohydrin C02666 Coniferylaldehyde C02669 D-Galactono-1,5-lactone C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02675 DihydrobiochaninA C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02704 Monomethylsulfate C02709 N-Acetoxyarylamine C02710 N-Acetyl-L-leucine C02714 N-Acetylputrescine C02717 N-Feruloyltyramine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02721 N-Methyl-L-alanine C02723 N-Methylputrescine C02726 N4-Phosphoagmatine C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02744 Psychosinesulfate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02780 2,5-Didehydro-D-gluconate C02787 2-Methylpropanamine C02788 2-trans-Hexadecenal C02798 3-Phosphonopyruvate C02800 4,5-Dioxopentanoate C02814 Benzene-1,2,4-triol C02824 Cyclohexylsulfamate C02827 D-Glucose6-sulfate C02835 Imidazole-4-acetate C02837 L-Lysine1,6-lactam C02876 Propanoylphosphate C02887 Sinapoylmalate C02888 Sorbose1-phosphate C02890 Tetrahydropalmatine C02895 Xylitol5-phosphate C02904 p-Menthane-3,8-diol C02906 Dihydromyricetin C02912 R-Propane-1,2-diol C02914 S-2-O-Sulfolactate C02916 S-Norlaudanosoline C02917 S-Propane-1,2-diol C02918 1-Methylnicotinamide C02920 2'-Hydroxyformononetin C02922 2'-O-Methyllicodione C02923 2,3-Dihydroxytoluene C02926 2-Aminobutan-4-olide C02927 2-Caffeoylisocitrate C02930 2-Methyleneglutarate C02934 3-Dehydrosphinganine C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02939 3-Methylbutanoyl-CoA C02944 3-cis-Dodecenoyl-CoA C02946 4-Acetamidobutanoate C02947 4-Coumaroylshikimate C02948 4-Hydroxyhexan-3-one C02949 4-Hydroxybenzoyl-CoA C02954 6-Aminopenicillanate C02964 D-Glucosyl-D-mannose C02977 GDP-6-deoxy-D-talose C02979 Glycerol2-phosphate C02983 L-2-Methyltryptophan C02985 L-Fucose1-phosphate C02991 L-Rhamnono-1,4-lactone C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C02997 N-Acetyl-L-histidine C03002 N-Caffeoylputrescine C03003 N-Glucosylnicotinate C03004 N-Hydroxy-L-tyrosine C03005 N-Methylanthranilate C03012 Naphthalene-1,2-diol C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03034 dTDP-D-galacturonate C03044 R,R-Butane-2,3-diol C03046 S,S-Butane-2,3-diol C03047 1,4-Diguanidinobutane C03052 2,3-Dihydrogossypetin C03056 2,6-Dihydroxypyridine C03057 2-Carboxybenzaldehyde C03058 2-Hydroxyglutaryl-CoA C03063 2-Oxohept-3-enedioate C03064 3-Dehydro-L-threonate C03065 3-Guanidinopropanoate C03067 3-Hydroxybenzaldehyde C03069 3-Methylcrotonyl-CoA C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03087 5-Acetamidopentanoate C03088 5-Hydroxymethyluracil C03089 5-Methylthio-D-ribose C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03107 D-Glucono-1,4-lactone C03112 DeacetylcephalosporinC C03115 Farnesyltriphosphate C03117 GDP-6-deoxy-D-mannose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03141 N-Benzoylanthranilate C03142 N-D-Glucosylarylamine C03145 N-Formyl-L-methionine C03147 N-Malonylanthranilate C03150 N-Ribosylnicotinamide C03153 N5-Methyl-L-glutamine C03160 2-Succinylbenzoyl-CoA C03164 Phenanthrene-3,4-diol C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03170 Oxidizedtrypanothione C03172 S-Methyl-L-methionine C03174 S-Succinylglutathione C03175 Shikimate3-phosphate C03187 dTDP-6-deoxy-L-talose C03190 +-Bornyl-diphosphate C03194 R-1-Aminopropan-2-ol C03198 S-4-Hydroxymandelate C03203 1-Hydroxy-2-naphthoate C03204 10-Formyldihydrofolate C03210 2,2'-Iminodipropanoate C03214 2-Amino-3-oxobutanoate C03217 2-Hydroxy-3-oxoadipate C03221 2-trans-Dodecenoyl-CoA C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03231 3-Methylglutaconyl-CoA C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03239 6-Amino-2-oxohexanoate C03241 6-Hydroxyhexan-6-olide C03246 ADPribose2'-phosphate C03248 Acetylenedicarboxylate C03263 CoproporphyrinogenIII C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03273 5-Oxopentanoate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03284 L-3-Amino-isobutanoate C03287 L-Glutamyl5-phosphate C03289 L-xylo-Hexulonolactone C03290 L-threo-3-Phenylserine C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03296 N2-Succinyl-L-arginine C03319 dTDP-6-deoxy-L-mannose C03329 S-Canadine C03340 L-2,3-Dihydrodipicolinate C03341 2-Amino-4-oxopentanoicacid C03344 2-Methylacetoacetyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03351 3-Hydroxybenzylalcohol C03354 3-Methylthiopropanamine C03360 4-Nitrophenylphosphate C03373 Aminoimidazoleribotide C03375 Bis3-aminopropylamine C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03393 4-Phospho-D-erythronate C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03410 N-Glycoloyl-neuraminate C03415 N2-Succinyl-L-ornithine C03427 Prephytoenediphosphate C03428 Presqualenediphosphate C03431 S-Inosyl-L-homocysteine C03440 cis-4-Hydroxy-D-proline C03442 dTDP-L-dihydrostreptose C03451 R-S-Lactoylglutathione C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03460 2-Methylprop-2-enoyl-CoA C03467 3-Oxo-4-methylpentanoicacid C03479 5-Formyltetrahydrofolate C03483 Adenosinetetraphosphate C03486 CDP-N-methylethanolamine C03492 D-4'-Phosphopantothenate C03493 D-4-Hydroxyphenylglycine C03495 Deoxy-5-methylcytidylate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03515 Luteolin7-O-glucuronide C03519 N-Acetyl-L-phenylalanine C03526 O-Sinapoylglucarolactone C03537 S-Acetylthioethanolamine C03539 S-Ribosyl-L-homocysteine C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03549 2-Hydroxycinnamate C03557 2-Aminoethylphosphonate C03561 R-3-Hydroxybutanoyl-CoA C03564 1-Pyrroline-2-carboxylate C03567 2'-Hydroxydihydrodaidzein C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03582 3,4',5-Trihydroxystilbene C03584 3-Uracil-1-yl-L-alanine C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03590 4-Hydroxyphenylglyoxylate C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03640 Sphingosyl-phosphocholine C03646 Bis-gamma-glutamylcystine C03648 cis-3,4-Leucopelargonidin C03652 2R,3S-2,3-Dimethylmalate C03656 S-5-Amino-3-oxohexanoicacid C03657 1,4-Dihydroxy-2-naphthoate C03659 1-O-Methyl-myo-inositol C03660 3-O-Methyl-myo-inositol C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03672 3-4-Hydroxyphenyllactate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03691 CMP-N-glycoloylneuraminate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03710 N-Benzyloxycarbonylglycine C03712 N2,N5-Dibenzoyl-L-ornithine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03739 trans-Cyclohexane-1,2-diol C03741 S-4-Amino-5-oxopentanoate C03742 S-4-Hydroxymandelonitrile C03750 2,6-Dioxo-6-phenylhexanoate C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03766 4-Hydroxyphenylacetonitrile C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03789 N,6-O-Disulfo-D-glucosamine C03790 N-Carboxymethyl-D-alanine C03794 N6-1,2-Dicarboxyethyl-AMP C03806 Substitutedbeta-aminoacid C03817 S-3-Imidazol-5-yllactate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03851 Adenosine5'-phosphoramidate C03861 Dibenzo1,4dioxin-2,3-dione C03871 L-2-Amino-6-oxoheptanedioate C03872 L-Serine-phosphoethanolamine C03897 Quercetin3,3',7-trissulfate C03898 Quercetin3,4',7-trissulfate C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03914 S-beta-Methylindolepyruvate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03951 Luteolin7-O-beta-D-glucoside C03955 N6-Acetyl-N6-hydroxy-L-lysine C03961 erythro-3-Hydroxy-L-aspartate C03962 --MenthylO-beta-D-glucoside C03964 R-3-4-Hydroxyphenyllactate C03971 1F-alpha-D-Galactosylraffinose C03972 2,3,4,5-Tetrahydrodipicolinate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C03986 3-Hydroxy-4-methylanthranilate C03993 4-beta-D-Glucosyloxybenzoate C03996 5'-O-beta-D-Glucosylpyridoxine C03997 5-Hydroxymethyldeoxycytidylate C04002 But-1-ene-1,2,4-tricarboxylate C04006 1D-myo-Inositol3-phosphate C04015 N-Acetyl-4-O-acetylneuraminate C04016 N-Acetyl-7-O-acetylneuraminate C04017 N-Acetyl-9-O-acetylneuraminate C04020 N2-D-1-Carboxyethyl-L-lysine C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04039 2,3-Dihydroxy-3-methylbutanoate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04047 3-Hydroxy-2-methylpropanoyl-CoA C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04053 5-Dehydro-4-deoxy-D-glucuronate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04076 L-2-Aminoadipate6-semialdehyde C04079 N-R-Pantothenoyl-L-cysteine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04091 cis-1,2-Dihydrobenzene-1,2-diol C04092 delta1-Piperideine-2-carboxylate C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04118 5,8,13,13a-Tetrahydrocolumbamine C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04137 N2-D-1-Carboxyethyl-L-arginine C04138 Nalpha-gamma-L-Glutamylhistamine C04148 alpha-N-Phenylacetyl-L-glutamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04187 5-Methyldeoxycytidinediphosphate C04188 S-Methyl-5-thio-D-ribose1-phosphate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04210 N5-L-1-Carboxyethyl-L-ornithine C04211 N6-Indol-3-ylacetyl-L-lysine C04216 all-trans-Heptaprenyldiphosphate C04217 all-trans-Pentaprenyldiphosphate C04221 trans-1,2-Dihydrobenzene-1,2-diol C04225 Z-But-2-ene-1,2,3-tricarboxylate C04226 6-oxo-1,4,5,6-tetrahydronicotinate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04236 2S-2-Isopropyl-3-oxosuccinate C04244 6-Lactoyl-5,6,7,8-tetrahydropterin C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04268 dTDP-4-amino-4,6-dideoxy-D-glucose C04271 6aR,11aR-3,9-Dihydroxypterocarpan C04272 R-2,3-Dihydroxy-3-methylbutanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C04280 1-Guanidino-1-deoxy-scyllo-inositol C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04290 4-3-Methylbut-2-enyl-L-tryptophan C04293 5,7,4'-Trihydroxy-3'-methoxyflavone C04294 5-2-Hydroxyethyl-4-methylthiazole C04297 CDP-4-dehydro-3,6-dideoxy-D-glucose C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04314 cis-1,2-Dihydronaphthalene-1,2-diol C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04327 4-Methyl-5-2-phosphoethyl-thiazole C04332 6,7-Dimethyl-8-1-D-ribityllumazine C04335 Nalpha-Benzyloxycarbonyl-L-leucine C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04352 R-4'-Phosphopantothenoyl-L-cysteine C04353 Z-4-Hydroxyphenylacetaldehyde-oxime C04359 1-Deoxy-D-altro-heptulose7-phosphate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C04409 2-Amino-3-carboxymuconatesemialdehyde C04411 2R,3S-3-Isopropylmalate C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04425 S-Adenosyl-4-methylthio-2-oxobutanoate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04437 1-5-Phosphoribosylimidazole-4-acetate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04443 3',4',5,7-Tetrahydroxy-3-methoxyflavone C04444 3',5-Dihydroxy-3,4',7-trimethoxyflavone C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04454 5-Amino-6-5'-phosphoribitylaminouracil C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04462 N-Succinyl-2-L-amino-6-oxoheptanedioate C04468 +-cis-3,4-Dihydrophenanthrene-3,4-diol C04471 4S,5S-4,5-Dihydroxy-2,6-dioxohexanoate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04498 N-4-Guanidinobutyl-4-hydroxycinnamide C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04509 di-trans,poly-cis-Decaprenyldiphosphate C04514 1S,2S-1,2-Dihydronaphthalene-1,2-diol C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04524 2-Protocatechoylphloroglucinolcarboxylate C04529 3S,4S-3-Hydroxytetradecane-1,3,4-tricarboxylate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04544 gamma-L-Glutamyl-L-cysteinyl-beta-alanine C04546 R-3-R-3-Hydroxybutanoyloxybutanoate C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04573 UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate C04574 di-trans,poly-cis-Undecaprenyldiphosphate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C04579 Inositol1,2,3,4,5-pentakisphosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04592 Toluene-cis-dihydrodiol C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate C04608 Apigenin7-O-beta-D-glucoside C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04634 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde C04655 2S,3S-2-Hydroxytridecane-1,2,3-tricarboxylate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04674 3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04700 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine C04702 UDPMurAcoyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04712 7-5-Carboxyl-5-oxopentanylaminocephalosporinate C04713 N6-delta2-Isopentenyl-adenosine5'-monophosphate C04732 4-1-D-Ribitylamino-5-amino-2,6-dihydroxypyrimidine C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04783 cis-4,5-Dihydroxycyclohexa-16,2-diene-1,2-dicarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04856 6S-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide C04858 Apigenin7-O-beta-D-apiosyl-1->2-beta-D-glucoside C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04877 UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate C04882 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04900 Luteolin7-O-beta-D-glucuronosyl-1->2-beta-D-glucuronide-4'-O-beta-D-glucuronide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05005 Glycolipid C05100 3-Ureidoisobutyrate C05108 14-Demethyllanosterol C05109 24,25-Dihydrolanosterol C05114 Mucopolysaccharide C05116 3-Hydroxybutanoyl-CoA C05127 N-Methylhistamine C05130 Imidazole-4-acetaldehyde C05131 1-Ribosylimidazole-4-acetate C05133 4-Imidazolone-5-acetate C05135 4-beta-Acetylaminoethylimidazole C05143 Dhurrin C05145 3-Aminoisobutanoate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05161 2,5-Diaminohexanoate C05165 2-Amino-5-oxocyclohex-1-enecarbonyl-CoA C05174 S-Cheilanthifoline C05175 6,7,12b,13e-Tetrahydro-4H-bis1,3benzodioxolo5,6-a:4',5'-gquinolizine C05176 S-N-Methylcoclaurine C05189 Protopine C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine C05193 12-Hydroxydihydrochelirubine C05194 Dihydrochelirubine C05195 3-Hydroxybenzoyl-CoA C05198 5'-Deoxyadenosine C05202 3'-Hydroxy-N-methyl-S-coclaurine C05231 L-3-Aminobutyryl-CoA C05235 Hydroxyacetone C05239 5-Aminoimidazole C05247 10-Hydroxydihydrosanguinarine C05258 S-3-Hydroxyhexadecanoyl-CoA C05259 3-Oxopalmitoyl-CoA C05260 S-3-Hydroxytetradecanoyl-CoA C05261 3-Oxotetradecanoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA C05263 3-Oxododecanoyl-CoA C05264 S-Hydroxydecanoyl-CoA C05265 3-Oxodecanoyl-CoA C05266 S-Hydroxyoctanoyl-CoA C05267 3-Oxooctanoyl-CoA C05268 S-Hydroxyhexanoyl-CoA C05269 3-Oxohexanoyl-CoA C05270 Hexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA C05274 Decanoyl-CoA C05275 trans-Dec-2-enoyl-CoA C05276 trans-Oct-2-enoyl-CoA C05281 5-Methylbarbiturate C05315 Palmatine C05316 Dihydromacarpine C05324 Nicotianamine C05328 D-2-Amino-hexano-6-lactam C05330 Homocysteine C05332 Phenethylamine C05338 4-Hydroxyphenylacetyl-CoA C05340 beta-Alanyl-L-arginine C05341 beta-Alanyl-L-lysine C05343 R-4-Hydroxymandelate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05376 BiochaninA-beta-D-glucoside C05378 beta-D-Fructose1,6-bisphosphate C05379 Oxalosuccinate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05385 D-Glucuronate1-phosphate C05394 3-Keto-beta-D-galactose C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05403 3-Ketolactose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05411 L-Xylonate C05412 L-Lyxonate C05413 Phytoene C05414 Phytofluene C05421 15-cis-Phytoene C05422 L-Dehydroascorbate C05426 RING C05427 Phytyldiphosphate C05430 zeta-Carotene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C05512 Deoxyinosine C05513 Urate-3-ribonucleoside C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05524 Aminoacyl-L-methionine C05526 S-Glutathionyl-L-cysteine C05527 3-Sulfinylpyruvate C05528 3-Sulfopyruvate C05529 H2S2O3 C05532 SO2 C05533 Oxaloglutarate C05539 N-Acetyl-L-2-amino-6-oxopimelate C05548 6-Acetamido-2-oxohexanoate C05551 PenicillinG C05552 N6-D-Biotinyl-L-lysine C05554 Aerobactin C05556 deltaL-2-Aminoadipyl-L-cysteinyl-D-valine C05557 IsopenicillinN C05560 L-2-Aminoadipateadenylate C05565 Hydantoin-5-propionate C05568 Imidazolelactate C05569 5'-Phospho-D-1-ribulosylformimine C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05576 3,4-Dihydroxyphenylethyleneglycol C05577 3,4-Dihydroxymandelaldehyde C05580 3,4-Dihydroxymandelate C05581 3-Methoxy-4-hydroxyphenylacetaldehyde C05582 Homovanillate C05583 3-Methoxy-4-hydroxyphenylglycolaldehyde C05584 3-Methoxy-4-hydroxymandelate C05585 Gentisatealdehyde C05587 3-Methoxytyramine C05588 L-Metanephrine C05589 L-Normetanephrine C05593 3-Hydroxyphenylacetate C05594 3-Methoxy-4-hydroxyphenylethyleneglycol C05595 4-Hydroxyphenylacetylglutamicacid C05596 4-Hydroxyphenylacetylglycine C05598 Phenylacetylglycine C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05607 Phenyllactate C05608 4-Hydroxycinnamylaldehyde C05610 Sinapoylaldehyde C05616 3-O-Methylgallate C05619 5-Hydroxyferulate C05620 N-Acetyl-D-phenylalanine C05622 Malonylapiin C05623 Quercetin3-O-glucoside C05625 Rutin C05627 4-Hydroxystyrene C05629 Phenylpropanoate C05631 Eriodictyol C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05638 5-Hydroxykynurenamine C05639 4,6-Dihydroxyquinoline C05640 Cinnavalininate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate C05642 Formyl-N-acetyl-5-methoxykynurenamine C05644 3-Methylindolepyruvate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05646 5-Hydroxyindolepyruvate C05647 Formyl-5-hydroxykynurenamine C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05654 5-2'-Formylethyl-4,6-dihydroxypicolinate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05656 5-3'-Carboxy-3'-oxopropyl-4,6-dihydroxypicolinate C05657 6-Hydroxyindolelactate C05658 Indoxyl C05660 5-Methoxyindoleacetate C05662 Homoisocitrate C05665 beta-Aminopropionaldehyde C05668 3-Hydroxypropionyl-CoA C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05717 alpha-Amino-gamma-cyanobutanoate C05730 Glutathionylspermidine C05731 3-Ketosucrose C05765 L-Glutamyl1-phosphate C05766 UroporphyrinogenI C05768 CoproporphyrinogenI C05772 Precorrin3A C05778 Sirohydrochlorin C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05820 L-Seryladenylate C05822 3'-CMP C05823 3-Mercaptolactate C05824 S-Sulfo-L-cysteine C05825 2-Amino-5-oxohexanoate C05827 Methylimidazoleacetaldehyde C05828 Methylimidazoleaceticacid C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05837 Glucobrassicin C05838 cis-2-Hydroxycinnamate C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05840 Iminoaspartate C05841 NicotinateD-ribonucleoside C05851 Coumarin C05852 2-Hydroxyphenylacetate C05853 Phenylethylalcohol C05854 4-Carboxy-2-oxo-4-pentanoate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C05892 UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine C05902 3-Methoxyapigenin C05903 Kaempferol C05904 Pelargonidin C05905 Cyanidin C05906 Leucocyanidin C05907 Luteoforol C05908 Delphinidin C05909 Leucodelphinidin C05911 Pentahydroxyflavanone C05921 Biotinyl-5'-AMP C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05928 10-FormyltetrahydrofolylL-glutamate C05931 N-Succinyl-L-glutamate C05932 N-Succinyl-L-glutamate5-semialdehyde C05933 N-omega-Hydroxyarginine C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05938 L-4-Hydroxyglutamatesemialdehyde C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05979 Propane-1-ol C05983 Propinoladenylate C05984 2-Hydroxybutanoicacid C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C05989 3-Oxopropionyl-CoA C05993 Acetyladenylate C05996 Branchedchainfattyacid C05998 3-Hydroxyisovaleryl-CoA C05999 Lactaldehyde C06000 S-3-Hydroxyisobutyryl-CoA C06001 S-3-Hydroxyisobutyrate C06002 S-Methylmalonatesemialdehyde C06004 R-3-Methyl-2-oxobutanoate C06006 S-2-Aceto-2-hydroxybutanoate C06007 R-2,3-Dihydroxy-3-methylpentanoate C06010 S-2-Acetolactate C06011 Benzenaminesulfate C06016 Pentosans C06017 dTDP-D-glucuronate C06018 dTDP-4-acetamido-4,6-dideoxy-D-glucose C06019 D-arabino-3-Hexulose6-phosphate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06044 4-Hydroxyphenylethanol C06045 3-Methoxy-4-hydroxyphenylacetate C06046 Salidroside C06047 Stizolobate C06048 Stizolobinate C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal C06054 2-Oxo-3-hydroxy-4-phosphobutanoate C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol C06059 Cyclicamidines C06074 Myrcene C06075 Terpinolene C06076 Comphene C06077 Pinene C06083 Tetrahymanol C06084 Hopanoid C06085 Triterpenoid C06086 Pimaradiene C06089 ent-Copalyldiphosphate C06090 ent-Kaurene C06093 GibberellinA12aldehyde C06099 +-Limonene C06101 Hexan-1-ol-6-oate C06102 Adipatesemialdehyde C06103 6-Hydroxyhexanoicacid C06104 Adipate C06105 Cyclohexan-1,2-dione C06111 Nerolidyldiphosphate C06114 gamma-Glutamyl-beta-aminopropiononitrile C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate C06121 3-Ketosphingosine C06123 Hexadecenal C06124 Sphingosine1-phosphate C06142 1-Butanol C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06149 6-3'-Triphosphoryl-1'-methylglyceryl-7-methyl-7,8-dihydrobiopterin C06156 alpha-D-Glucosamine1-phosphate C06159 2-Dehydro-3-deoxy-D-fuconate C06160 S-Norcoclaurine C06161 S-Coclaurine C06162 Sanguinarine C06163 S-cis-N-methylstylopine C06165 Macarpine C06178 1-Methylpyrrolinium C06180 Anabasine C06181 Piperideine C06182 Pelletierine C06183 Anapheline C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06199 Hordenine C06201 2,4-Dihydroxyhept-2-enedioate C06202 Salicylaldehyde C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06205 1,2-Dihydronaphthalene-1,2-diol C06206 Benzoylphosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06212 N-Methylserotonin C06213 N-Methyltryptamine C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06231 Ectoine C06234 4-Methyl-L-glutamate C06240 UDP-N-acetyl-D-mannosaminouronate C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06245 Phylloquinol C06307 --beta-Pinene C06308 --alpha-Pinene C06309 Diplopterol C06310 Diploptene C06311 Galactitol1-phosphate C06312 L-Tagatose6-phosphate C06313 Biopterin C06316 D-erythro-Ascorbate C06317 4-Hydroxy-3-methoxy-benzenemethanol C06318 3S,4R-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate C06319 Precorrin6Y C06320 Precorrin6X C06321 1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylicacid C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06327 Chelirubine C06330 Quinoline-3,4-diol C06333 2-Aminobenzenesulfonate C06335 4-Aminobenzenesulfonate C06336 3-Sulfocatechol C06337 Terephthalate C06343 Quinolin-4-ol C06352 4-O-Methyl-myo-inositol C06353 6-O-Methyl-myo-inositol C06355 2,3',4,6-Tetrahydroxybenzophenone C06356 2,4,6-Trihydroxybenzophenone C06358 Methylcinnamate C06359 Ethylcinnamate C06360 Propylcinnamate C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06394 +-delta-Cadinene C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06399 Hydrogenobyrinate C06406 Precorrin3B C06407 Precorrin4 C06408 Precorrin8X C06416 Precorrin5 C06430 D-Galacturonolactone C06432 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanine C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06442 N-gamma-Acetyldiaminobutyrate C06503 Hydrogenobyrinatea,cdiamide C06517 S-6-O-Methylnorlaudanosoline C06518 S-Nororientaline C06519 S-3'-Hydroxycoclaurine C06520 S-Norreticuline C06547 Ethylene C06548 Ethyleneoxide C06554 Cyanuricacid C06555 Biuret C06561 Isosalipurpol C06562 +-Catechin C06563 Genistein C06564 PenicillinN C06565 DeacetoxycephalosporinC C06566 CephamycinC C06568 O-Carbamoyl-deacetylcephalosporinC C06569 7a-Hydroxy-o-carbamoyl-deacetylcephalosporinC C06588 Biphenyl C06589 cis-2,3-Dihydro-2,3-dihydroxybiphenyl C06593 epsilon-Caprolactam C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06625 Malonamoyl-CoA C06631 dTDP-beta-L-mycarose C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06672 Vanillate C06673 4-Carboxy-4'-sulfoazobenzene C06674 4-Sulfocatechol C06675 3-Sulfomuconate C06676 4-Sulfolactone C06677 Toluene-4-sulfonate C06678 4-Sulfobenzylalcohol C06679 4-Sulfobenzaldehyde C06680 4-Hydroxyphthalate C06701 Phosphonate C06711 Fluoren-9-ol C06712 Fluoren-9-one C06714 3-Hydroxypimeloyl-CoA C06715 3-Oxopimeloyl-CoA C06719 Dihydrophloroglucinol C06720 1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate C06723 6-Carboxyhex-2-enoyl-CoA C06727 cis-1,2-Dihydro-3-ethylcatechol C06728 3-Ethylcatechol C06729 cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate C06730 4-Methylcatechol C06731 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate C06732 alpha,beta-Didehydrotryptophan C06735 Aminoacetaldehyde C06736 E-11-Tetradecenoyl-CoA C06737 Z-11-Tetradecenoyl-CoA C06742 2-2-Hydroxyphenylbenzenesulfinate C06746 N-Acetylphenylethylamine C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C06756 p-Xylene C06757 4-Methylbenzylalcohol C06758 p-Tolualdehyde C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06876 Nitrosobenzene C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C06986 Spirodilactone C07024 3'-Keto-3'-deoxy-ATP C07025 3'-Keto-3'-deoxy-AMP C07083 Styrene C07084 Styrenecis-glycol C07085 3-Vinylcatechol C07086 Phenylaceticacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07111 Ethylbenzene C07112 1-Phenylethanol C07113 Acetophenone C07114 Benzoylacetate C07118 Benzoylacetyl-CoA C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07130 Theophylline C07189 2-Hydroxyacetophenone C07208 m-Xylene C07209 3-Methylbenzaldehyde C07211 m-Methylbenzoate C07212 o-Xylene C07213 2-Methylbenzylalcohol C07214 2-Methylbenzaldehyde C07215 o-Toluate C07216 3-Methylbenzylalcohol C07271 Limonene-1,2-epoxide C07272 Maleimide C07276 Limonene-1,2-diol C07277 dTDP-D-fucose C07301 R-Mandelamide C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA C07305 ProductsofATPbreakdown C07331 Carbonylsulfide C07335 2-Amino-3-oxo-4-phosphonooxybutyrate C07350 3-Methyl-1-2,4,6-trihydroxyphenylbutan-1-one C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07480 Theobromine C07481 Caffeine C07715 Fluorene C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07719 2-Formyl-1-indanone C07720 3-Hydroxy-1-indanone C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07726 1-Formyl-2-indanone C07729 Dibenzofuran C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07732 Dibenzo-p-dioxin C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07756 7-Aminocephalosporanicacid C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08060 Carbazole C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08063 1,4-Cyclohexanedione C08276 3-Methylthiopropionicacid C08481 Indican C08576 Aureusidin C08577 Bracteatin C08578 Butein C08586 delta-Carotene C08604 Cyanidin3-O-glucoside C08615 alpha-Amyrin C08616 beta-Amyrin C08620 Cyanidin3-O-rutinoside C08628 Lupeol C08639 Cyanin C08650 Isoliquiritigenin C08725 Pelargonin C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C08830 24-Methylenecycloartanol C08980 SoyasapogenolB C09099 Naringenin7-O-beta-D-glucoside C09126 Genistein7-O-beta-D-glucoside C09306 Sulfurdioxide C09320 Afzelechin C09332 Tetrahydrofolyl-Glu2 C09614 Butin C09727 --Epicatechin C09736 Fisetinidol-4beta-ol C09751 Garbanzol C09756 Homoeriodictyol C09762 Liquiritigenin C09789 Naringin C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA C09814 Benzonitrile C09815 Benzamide C09816 Benzylsuccinate C09817 Benzylsuccinyl-CoA C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA C09820 Benzoylsuccinyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA C09826 Pinobanksin C09827 Pinocembrin C09893 Pulegone C10020 Apigenin7-6''-malonylglucoside C10098 Kaempferide C10107 Myricetin C10175 Quercetin3-2G-xylosylrutinoside C10192 Tricetin C10200 Anhydroglycinol C10208 Daidzein C10216 Daidzin C10419 Ferreirin C10422 --GlyceollinII C10434 5-O-Caffeoylshikimicacid C10502 --Maackiain C10503 --Medicarpin C10509 Ononin C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C10520 Pratensein C10521 Prunetin C10522 Pseudobaptigenin C10538 Trifolirhizin C10700 4'-Hydroxyacetophenone C10906 D-Fructose C10945 Caffeicaldehyde C10974 4-Methylaminobutanal C11038 2'-Deoxy-5-hydroxymethylcytidine-5'-diphosphate C11039 2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate C11062 4-Hydroxybutyryl-CoA C11130 3-Hydroxyindolin-2-one C11174 1-Diphosinositolpentakisphosphate C11249 Cyclohexane C11348 S-1-Phenylethanol C11354 2-Hydroxy-cis-hex-2,4-dienoate C11355 4-Amino-4-deoxychorismate C11356 trans,trans,cis-Geranylgeranyldiphosphate C11383 +-S-Carvone C11388 --Linalool C11389 +-Linalool C11395 4R,6R-cis-Carveol C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate C11408 4S,6S-cis-Carveol C11409 +-trans-Carveol C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol C11422 Phenanthracene C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C11427 1-Hydroxy-2-naphthaldehyde C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol C11434 2-C-Methyl-D-erythritol4-phosphate C11435 4-Cytidine5'-diphospho-2-C-methyl-D-erythritol C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11437 1-Deoxy-D-xylulose5-phosphate C11453 2-C-Methyl-D-erythritol2,4-cyclodiphosphate C11455 4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol C11457 3-3-Hydroxy-phenyl-propanoicacid C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11481 HSO3- C11499 S-3-Sulfolactate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11513 24R-24-Methylcycloarta-25-en-3-beta-ol C11514 E-3-Methoxycarbonylpent-2-enedioate C11515 E-2-Methoxycarbonylmethylbutenedioate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide C11521 UDP-6-sulfoquinovose C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11536 2R-O-Phospho-3-sulfolactate C11537 2R-3-Sulfolactate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11588 cis-3-Carboxy-ethyl-3,5-cyclo-hexadiene-1,2-diol C11620 Syringetin C11631 9-Riburonosylhypoxanthine C11638 3-Amino-2-oxopropylphosphate C11713 beta-Naphthol C11714 alpha-Naphthol C11811 1-Hydroxy-2-methyl-2-butenyl4-diphosphate C11818 R-Canadine C11821 5-Hydroxyisourate C11822 2-Aminomalonatesemialdehyde C11824 Cyclicamide C11838 S-4,5-dihydroxypentan-2,3-dione C11857 GibberellinA12 C11859 GibberellinA37openlactone C11860 GibberellinA15openlactone C11861 GibberellinA24 C11862 GibberellinA36 C11872 Kaur-16-en-18-ol C11873 Kaur-16-en-18-al C11874 Kaur-16-en-18-oicacid C11875 ent-7alpha-Hydroxykaur-16-en-19-oicacid C11876 6beta,7beta-Dihydroxykaurenoicacid C11877 +-Sandaracopimaradiene C11878 --Abietadiene C11879 Levopimaradiene C11880 Neoabietadiene C11881 Palustradiene C11894 Taxa-45,1112-diene C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11915 dTDP-3-methyl-4-oxo-2,6-dideoxy-L-glucose C11916 dTDP-L-mycarose C11920 dTDP-L-olivose C11921 dTDP-L-oleandrose C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose C11924 Perillicacid C11925 dTDP-3-amino-3,6-dideoxy-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose C11929 Perillyl-CoA C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose C11933 dTDP-D-mycaminose C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA C11937 1S,4R-1-Hydroxy-2-oxolimonene C11951 +-cis-Isopulegone C11952 +-Isomenthone C12092 N-Methylanthraniloyl-CoA C12093 1,3-Dihydroxy-N-methylacridone C12095 Cyanidin3-O-6-O-p-coumaroylglucoside C12096 Cyanidin3-O-6-O-p-coumaroylglucoside-5-O-glucoside C12123 7,4'-Dihydroxyflavone C12124 Apiforol C12125 Isoformononetin C12127 +-Gallocatechin C12128 --Epiafzelechin C12134 2'-Hydroxygenistein C12135 2'-HydroxybiochaninA C12136 --Epigallocatechin C12137 Pelargonidin3-O-glucoside C12138 Delphinidin3-O-glucoside C12142 Vetispiradiene C12144 Phytosphingosine C12203 5-Hydroxyferuloyl-CoA C12204 5-Hydroxyconiferaldehyde C12205 5-Hydroxyconiferylalcohol C12206 Caffeylalcohol C12208 p-Coumaroylquinicacid C12209 Caffeoylquinicacid C12210 UDP-3-ketoglucose C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12249 Kaempferol3-O-glucoside C12312 Indolin-2-one C12313 cis-Cyclohexane-1,2-diol C12314 1-Oxa-2-oxo-3-hydroxycycloheptane C12316 cis-Dihydroquercetin C12318 dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12321 dTDP-L-epivancosamine C12322 dTDP-L-vancosamine C12323 L-4-Hydroxyphenylglycine C12455 5-Aminopentanal C12456 3-Dimethylallyl-4-hydroxyphenylpyruvate C12457 3-Dimethylallyl-4-hydroxymandelicacid C12458 3-Dimethylallyl-4-hydroxybenzoate C12481 dTDP-5-dimethyl-L-lyxose C12621 trans-3-Hydroxycinnamate C12622 cis-3-3-Carboxyethenyl-3,5-cyclohexadiene-1,2-diol C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12625 BiochaninA7-O-6-O-malonyl-beta-D-glucoside C12626 Kaempferol3-O-beta-D-galactoside C12627 Apigenin7-O-neohesperidoside C12630 Luteolin7-O-neohesperidoside C12631 2-Hydroxy-2,3-dihydrogenistein C12632 Luteolin7-O-beta-D-glucuronosyl-1->2-beta-D-glucuronide C12633 Laricitrin C12634 Kaempferol3-O-beta-D-glucosyl-1->2-beta-D-glucoside C12635 Kaempferol3-O-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12636 Kaempferol3-O-6-4-coumaroyl-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12637 Quercetin3-O-beta-D-xylosyl-1->2-beta-D-glucoside C12638 Quercetin3-O-6-O-malonyl-beta-D-glucoside C12639 Quercetin7-O-beta-D-glucoside C12640 Pelargonidin3-O-6-caffeoyl-beta-D-glucoside5-O-beta-D-glucoside C12641 4'''-Demalonylsalvianin C12642 Pelargonidin3-O-6-O-malonyl-beta-D-glucoside C12643 Cyanidin3-O-6-O-malonyl-beta-D-glucoside C12644 Pelargonidin3-O-rutinoside C12645 Pelargonidin3-O-rutinoside5-O-beta-D-glucoside C12646 Cyanidin3-O-rutinoside5-O-beta-D-glucoside C12647 Salvianin C12667 Quercetin3-O-beta-D-glucosyl-1->2-beta-D-glucoside C12668 Quercetin3-O-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12838 trans-4-Carboxymethylenebut-2-en-4-olide C12986 N2-Acetyl-L-aminoadipate C12987 N2-Acetyl-L-aminoadipyl-delta-phosphate C12988 N2-Acetyl-L-aminoadipatesemialdehyde C12989 N2-Acetyl-L-lysine C13309 2-Phytyl-1,4-naphthoquinone C13425 3-Hexaprenyl-4-hydroxybenzoate C13482 Phosphodimethylethanolamine C13624 BisphenolA C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene C13633 2,2-Bis4-hydroxyphenyl-propanoicacid C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13637 4-Ethylphenol C13638 1-4'-Hydroxyphenylethanol C13747 1,7-Dimethylxanthine C13952 UDP-N-acetyl-D-galactosaminuronicacid C14082 1-Methylnaphthalene C14083 cis-1,2-Dihydroxy-1,2-dihydro-8-methylnaphthalene C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14087 3-Methylsalicylaldehyde C14088 3-Methylsalicylate C14089 1-Hydroxymethylnaphthalene C14090 1-Naphthaldehyde C14091 1-Naphthoicacid C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14103 4-Methylsalicylate C14143 Adipyl-CoA C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA C14146 alpha-Zeacarotene C14151 delta-Tocopherol C14152 beta-Tocopherol C14179 Sulfoacetate C14180 S-Hydroxymethylglutathione C14314 4',6,7-Trihydroxyisoflavone C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14783 1,2-Naphthoquinone C14784 1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15483 D-Galactonolactone C15485 2'-Deoxymugineicacid C15486 3''-Deamino-3''-oxonicotianamine C15499 Pentane-2,4-dione C15500 Mugineicacid C15501 3-Epihydroxymugineicacid C15502 3-Epihydroxy-2'-deoxymugineicacid C15503 N,N-Dihydroxy-L-tyrosine C15509 2-Dimethylallyl-6aS,11aS-3,6a,9-trihydroxypterocarpan C15510 4-Dimethylallyl-6aS,11aS-3,6a,9-trihydroxypterocarpan C15511 GlyceollinIII C15522 4a-Hydroxytetrahydrobiopterin C15523 2,6-Dihydroxynicotinate C15524 Phenylglyoxylyl-CoA C15525 Eriodictyolchalcone C15526 3-Methylhistamine C15527 Precorrin1 C15530 Corydaline C15531 2'-O-Methylisoliquiritigenin C15532 N-Acetyl-L-citrulline C15536 DihydromonacolinL C15547 1,4-Dihydroxy-2-naphthoyl-CoA C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15567 2,7,4'-Trihydroxyisoflavanone C15585 myo-Inositolphosphate C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15601 Glyceollin C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15607 3-Oxo-3-ureidopropanoate C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate C15666 7R-7-4-Carboxybutanamidocephalosporanate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15769 HBOA C15770 DIBOA C15772 DIBOA-glucoside C15804 p-Hydroxyphenyllignin C15805 Guaiacyllignin C15806 Syringyllignin C15807 5-Hydroxy-guaiacyllignin C15809 Iminoglycine C15810 C15810 C15811 C15811 C15812 C15812 C15813 C15813 C15814 C15814 C15815 C15815 C15853 Dehydrospermidine C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15877 Anhydrorhodovibrin C15878 Rhodovibrin C15879 Hydroxyspirilloxanthin C15881 Spirilloxanthin C15882 2-Methyl-6-phytylquinol C15883 2,3-Dimethyl-5-phytylquinol C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin C15888 3,4,3',4'-Tetrahydrospirilloxanthin C15892 Chloroxanthin C15898 Demethylspheroidene C15900 Spheroidene C15902 Hydroxyspheroidene C15903 Spheroidenone C15905 Hydroxyspheroidenone C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C15915 4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15930 L-Galactonate C15980 S-2-Methylbutanoyl-CoA C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16028 Amorpha-4,11-diene C16069 3-Sulfolactate C16071 Riboflavincyclic-4',5'-phosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16141 +-GermacreneA C16142 --GermacreneD C16143 1E,4S,5E,7R-Germacra-110,5-dien-11-ol C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16153 UDP-L-Ara4N C16154 UDP-L-Ara4FN C16155 UDP-L-Ara4O C16159 2-Formylglutarate C16186 L-Ascorbate6-phosphate C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16190 2,7-Dihydroxy-4'-methoxyisoflavanone C16191 Malonyldaidzin C16192 Malonylgenistin C16199 5-Sulfosalicylate C16201 1-Naphthalenesulfonicacid C16202 2-Naphthalenesulfonicacid C16215 1,2-Dihydrophthalicacid C16216 3-Oxostearoyl-CoA C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA C16222 Formononetin7-O-glucoside-6''-O-malonate C16223 --Medicocarpin C16224 Medicarpin3-O-glucoside-6'-malonate C16225 --Vestitol C16226 2',7-Dihydroxy-4',5'-methylenedioxyisoflavone C16227 +-Sophorol C16228 --Sophorol C16229 +-Maackiain C16231 --Maackiain-3-O-glucosyl-6''-O-malonate C16232 6,7,4'-Trihydroxyflavanone C16233 2,6,7,4'-Tetrahydroxyisoflavanone C16234 o-Nitrobenzoate C16235 o-Hydroxylaminobenzoate C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16267 Cyclopropanecarboxylate C16268 Cyclopropanecarboxyl-CoA C16269 epi-Isozizaene C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16276 epsilon-Carotene C16288 Pelargonidin3-O-3'',6''-O-dimalonylglucoside C16289 Cyanidin3-O-3'',6''-O-dimalonylglucoside C16290 Delphinidin3-O-3'',6''-O-dimalonylglucoside C16297 Pelargonidin3-O-6-caffeoyl-beta-D-glucoside C16299 Malonylshisonin C16301 Delphinidin3-O-6-O-malonyl-beta-D-glucoside C16303 TernatinC5 C16304 Delphinidin3-O-6''-O-malonyl-beta-glucoside-3'-O-beta-glucoside C16305 Pelargonidin3-O-sophoroside C16306 Cyanidin3-O-sophoroside C16307 Delphinidin3-O-sophoroside C16312 Delphin C16313 Delphinidin3-glucoside5-caffoyl-glucoside C16314 Delphinidin3,5,3'-triglucoside C16315 Tulipanin C16349 Pelargonidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16350 Cyanidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16351 Delphinidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16352 7-Methylxanthosine C16353 7-Methylxanthine C16354 Albireodelphin C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16357 3-Methylxanthine C16358 1-Methylxanthine C16359 1-Methyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea C16367 Delphinidin3-O-6-caffeoyl-beta-D-glucoside C16368 Pelargonidin3-6-p-coumaroylglucoside C16369 Cyanidin3-6-p-caffeoylglucoside C16370 Delphinidin3-6-p-coumaroylglucoside C16371 Pelargonidin3-glucoside5-caffeoylglucoside C16372 Cyanidin3-glucoside5-caffeoylglucoside C16373 Cyanidin-3-O-6''-O-malonyl-2''-O-glucuronylglucoside C16390 S-2-Hydroxymethylglutarate C16404 Pinocembrinchalcone C16405 Homoeriodictyolchalcone C16406 Phlorizinchalcone C16415 5-Deoxyleucopelargonidin C16416 Desmethylxanthohumol C16423 Naringinchalcone C16432 5-Hydroxyectoine Consensus scope of cluster 20 C00001 H2O C00007 Oxygen C00010 CoA C00027 H2O2 C00080 H+ C00136 Butanoyl-CoA C00630 2-Methylpropanoyl-CoA C00704 O2.- C02939 3-Methylbutanoyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03460 2-Methylprop-2-enoyl-CoA C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C05996 Branchedchainfattyacid C06000 S-3-Hydroxyisobutyryl-CoA C06001 S-3-Hydroxyisobutyrate C15980 S-2-Methylbutanoyl-CoA Consensus scope of cluster 21 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00031 D-Glucose C00033 Acetate C00080 H+ C00088 Nitrite C00089 Sucrose C00095 D-Fructose C00140 N-Acetyl-D-glucosamine C00159 D-Mannose C00185 Cellobiose C00192 Hydroxylamine C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00244 Nitrate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00282 Hydrogen C00329 D-Glucosamine C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00645 N-Acetyl-D-mannosamine C00697 Nitrogen C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01133 N-Acetyl-D-glucosaminate C01674 Chitobiose C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02655 6-Acetyl-D-glucose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C03752 2-Amino-2-deoxy-D-gluconate C05359 e- C05360 Diimine C05361 Hydrazine C05383 Aminosugars C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06244 Acetamide C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 22 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 23 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11383 +-S-Carvone C11408 4S,6S-cis-Carveol C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol Consensus scope of cluster 24 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00509 Naringenin C00704 O2.- C05631 Eriodictyol C06561 Isosalipurpol C06563 Genistein C08576 Aureusidin C08577 Bracteatin C12631 2-Hydroxy-2,3-dihydrogenistein C15525 Eriodictyolchalcone Consensus scope of cluster 25 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00376 Retinal C00704 O2.- C00777 Retinoate C02094 beta-Carotene C02110 11-cis-Retinal C05918 all-trans-Dehydroretinal C05919 11-cis-Dehydroretinal C15943 Isorenieratene C16340 beta-Isorenieratene Consensus scope of cluster 26 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01595 Linoleate C04056 9-cis,11-trans-Octadecadienoate C04717 9Z,11E-13S-13-Hydroperoxyoctadeca-9,11-dienoicacid C07338 9Z,12Z-11S-11-Hydroperoxyoctadeca-9,12-dienoicacid C07354 7S,8S-DiHODE C14827 9S-HPODE C14831 8R-HPODE Consensus scope of cluster 27 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01693 L-Dopachrome C03459 2-Hydroxy-3-oxosuccinate C04185 5,6-Dihydroxyindole-2-carboxylate C05578 5,6-Dihydroxyindole C05579 Indole-5,6-quinone C05604 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole C05606 Melanin C15566 D-Dopachrome Consensus scope of cluster 28 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00877 Crotonoyl-CoA C01144 S-3-Hydroxybutanoyl-CoA C02331 Vinylacetyl-CoA C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Consensus scope of cluster 29 C00001 H2O C00007 Oxygen C00027 H2O2 C00031 D-Glucose C00080 H+ C00089 Sucrose C00095 D-Fructose C00124 D-Galactose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00243 Lactose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00392 Mannitol C00492 Raffinose C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00880 D-Galactonate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01216 2-Dehydro-3-deoxy-D-galactonate C01613 Stachyose C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03269 D-galacto-Hexodialdose C03383 D-Galactono-1,4-lactone C03661 1F-beta-D-Fructosylsucrose C03971 1F-alpha-D-Galactosylraffinose C05399 Melibiitol C05400 Epimelibiose C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 30 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen C05793 L-Urobilin C05794 I-Urobilin C05795 D-Urobilin Consensus scope of cluster 31 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00250 Pyridoxal C00314 Pyridoxine C00704 O2.- C00847 4-Pyridoxate C00971 4-Pyridoxolactone C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal Consensus scope of cluster 32 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00014 NH3 C00027 H2O2 C00031 D-Glucose C00033 Acetate C00058 Formate C00067 Formaldehyde C00080 H+ C00085 D-Fructose6-phosphate C00088 Nitrite C00089 Sucrose C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00132 Methanol C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00159 D-Mannose C00184 Glycerone C00185 Cellobiose C00191 D-Glucuronate C00192 Hydroxylamine C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00218 Methylamine C00221 beta-D-Glucose C00227 Acetylphosphate C00231 D-Xylulose5-phosphate C00244 Nitrate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00282 Hydrogen C00329 D-Glucosamine C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00357 N-Acetyl-D-glucosamine6-phosphate C00392 Mannitol C00447 D-Sedoheptulose1,7-bisphosphate C00488 Formamide C00514 D-Mannonate C00536 Triphosphate C00546 Methylglyoxal C00577 D-Glyceraldehyde C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00629 2-Dehydro-D-gluconate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C00697 Nitrogen C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00905 D-Fructuronate C00969 3-Hydroxypropanal C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01133 N-Acetyl-D-glucosaminate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01326 Hydrogencyanide C01674 Chitobiose C01742 Palatinose C01888 Aminoacetone C02013 Cellotetraose C02048 Laminaribiose C02336 beta-D-Fructose C02466 Trimetaphosphate C02591 Sucrose6-phosphate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03546 myo-Inositol4-phosphate C03661 1F-beta-D-Fructosylsucrose C03736 alpha-D-Ribose5-phosphate C03752 2-Amino-2-deoxy-D-gluconate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C05345 beta-D-Fructose6-phosphate C05359 e- C05360 Diimine C05361 Hydrazine C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05682 Phosphonoacetate C05999 Lactaldehyde C06019 D-arabino-3-Hexulose6-phosphate C06156 alpha-D-Glucosamine1-phosphate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06244 Acetamide C06440 2-Dehydro-D-glucono-1,5-lactone C07836 D-glycero-D-manno-Heptose7-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15585 myo-Inositolphosphate Consensus scope of cluster 33 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01327 HCl C02933 3,5-Dichlorocatechol C03918 2,4-Dichloro-cis,cis-muconate C04625 2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06328 6-Chlorobenzene-1,2,4-triol C06329 2-Chloromaleylacetate C07094 3,6-Dichlorocatechol C07095 2,5-Dichloro-cis,cis-muconate C07097 2,6-Dichlorohydroquinone Consensus scope of cluster 34 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11396 1R,2R,4R-Dihydrocarveol C11397 1R,2S,4R-Neo-dihydrocarveol C11398 1R,4R-Dihydrocarvone C11399 1S,2S,4R-Iso-dihydrocarveol C11400 1S,2R,4R-Neoiso-dihydrocarveol C11401 1S,4R-Iso-dihydrocarvone Consensus scope of cluster 35 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14453 4-Bromophenol C14839 Bromobenzene-3,4-oxide C14843 4-Bromocatechol C14844 Bromobenzene-3,4-dihydrodiol C14845 4-Bromophenol-2,3-epoxide C14846 4-Bromo-3,5-cyclohexadiene-1,2-dione Consensus scope of cluster 36 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C08650 Isoliquiritigenin C09762 Liquiritigenin C10200 Anhydroglycinol C10208 Daidzein C12123 7,4'-Dihydroxyflavone C15567 2,7,4'-Trihydroxyisoflavanone Consensus scope of cluster 37 C00001 H2O C00007 Oxygen C00027 H2O2 C00059 Sulfate C00080 H+ C00087 Sulfur C00094 Sulfite C00283 Hydrogensulfide C00320 Thiosulfate C00704 O2.- C01861 Trithionate C11481 HSO3- Consensus scope of cluster 38 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00124 D-Galactose C00704 O2.- C00880 D-Galactonate C01216 2-Dehydro-3-deoxy-D-galactonate C03269 D-galacto-Hexodialdose C03383 D-Galactono-1,4-lactone Consensus scope of cluster 39 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00137 myo-Inositol C00191 D-Glucuronate C00704 O2.- C00905 D-Fructuronate C02670 D-Glucuronolactone C03387 D-Glucurono-6,2-lactone Consensus scope of cluster 40 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00751 Squalene C06083 Tetrahymanol C06084 Hopanoid C06309 Diplopterol C06310 Diploptene Consensus scope of cluster 41 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00088 Nitrite C00189 Ethanolamine C00192 Hydroxylamine C00244 Nitrate C00266 Glycolaldehyde C00282 Hydrogen C00697 Nitrogen C00704 O2.- C01548 Acetylene C01837 Nitroethane C05359 e- C05360 Diimine C05361 Hydrazine C06771 Triethanolamine C06772 Diethanolamine Consensus scope of cluster 42 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01327 HCl C06547 Ethylene C06789 Tetrachloroethene C06790 Trichloroethene C06791 trans-1,2-Dichloroethene C06792 cis-1,2-Dichloroethene C06793 Vinylchloride Consensus scope of cluster 43 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 44 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02880 Protochlorophyllide C04536 Magnesiumprotoporphyrinmonomethylester C11829 131-Hydroxy-magnesium-protoporphyrinIX13-monomethylester C11830 131-Oxo-magnesium-protoporphyrinIX13-monomethylester C11831 Divinylprotochlorophyllide Consensus scope of cluster 45 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00843 --Menthone C02485 --Isopiperitenone C09893 Pulegone C11951 +-cis-Isopulegone C11952 +-Isomenthone Consensus scope of cluster 46 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C08585 Capsorubin C08606 Neoxanthin C08614 Violaxanthin C13431 9'-cis-Neoxanthin C13433 9-cis-Violaxanthin C13453 Xanthoxin C14044 C25-Allenic-apo-aldehyde C14045 C25-Epoxy-apo-aldehyde Consensus scope of cluster 47 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00146 Phenol C00156 4-Hydroxybenzoate C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol Consensus scope of cluster 48 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06205 1,2-Dihydronaphthalene-1,2-diol C11713 beta-Naphthol C11714 alpha-Naphthol C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide Consensus scope of cluster 49 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00080 H+ C00536 Triphosphate C00704 O2.- C02466 Trimetaphosphate Consensus scope of cluster 50 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00148 L-Proline C00704 O2.- C00763 D-Proline C01110 5-Amino-2-oxopentanoicacid C03564 1-Pyrroline-2-carboxylate Consensus scope of cluster 51 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C01852 Secologanin C02916 S-Norlaudanosoline C03758 4-2-Aminoethyl-1,2-benzenediol C04043 3,4-Dihydroxyphenylacetaldehyde C05359 e- C05360 Diimine C05361 Hydrazine C07304 Deacetylisoipecoside C07307 Deacetylipecoside Consensus scope of cluster 52 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01987 2-Aminophenol C02161 Isophenoxazine C02720 N-Hydroxyarylamine C03824 2-Aminomuconatesemialdehyde Consensus scope of cluster 53 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00757 Berberine C01795 Columbamine C03329 S-Canadine C04118 5,8,13,13a-Tetrahydrocolumbamine Consensus scope of cluster 54 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01024 Hydroxymethylbilane C01051 UroporphyrinogenIII C01079 ProtoporphyrinogenIX C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02191 Protoporphyrin C03263 CoproporphyrinogenIII C03459 2-Hydroxy-3-oxosuccinate C05766 UroporphyrinogenI C05768 CoproporphyrinogenI Consensus scope of cluster 55 C00001 H2O C00007 Oxygen C00027 H2O2 C00032 Heme C00080 H+ C00704 O2.- C01079 ProtoporphyrinogenIX C02191 Protoporphyrin C05783 Cytochromea C05784 Catalase C05785 Peroxidase C14818 Fe2+ C14819 Fe3+ Consensus scope of cluster 56 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00331 Indolepyruvate C00637 Indole-3-acetaldehyde C00704 O2.- C00954 Indole-3-acetate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate Consensus scope of cluster 57 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02226 2-Methylmaleate C02612 R-2-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate Consensus scope of cluster 58 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04053 5-Dehydro-4-deoxy-D-glucuronate C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate Consensus scope of cluster 59 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00080 H+ C00266 Glycolaldehyde C00536 Triphosphate C00704 O2.- C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C02466 Trimetaphosphate C03684 6-Pyruvoyltetrahydropterin C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine Consensus scope of cluster 60 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06328 6-Chlorobenzene-1,2,4-triol C06329 2-Chloromaleylacetate Consensus scope of cluster 61 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00333 D-Galacturonate C00558 D-Tagaturonate C00704 O2.- C02273 Digalacturonate C06430 D-Galacturonolactone Consensus scope of cluster 62 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01255 N-6-Aminohexanoyl-6-aminohexanoate C02378 6-Aminohexanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C06593 epsilon-Caprolactam Consensus scope of cluster 63 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01327 HCl C06594 1,2,4-Trichlorobenzene C06595 gamma-Hexachlorocyclohexane C06596 gamma-Pentachlorocyclohexene C06597 1,3,4,6-Tetrachloro-1,4-cyclohexadiene C06598 2,4,5-Trichloro-2,5-cyclohexadiene-1-ol C06599 2,5-Dichloro-2,5-cyclohexadiene-1,4-diol C06602 2,5-Dichlorophenol Consensus scope of cluster 64 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00704 O2.- C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid Consensus scope of cluster 65 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06714 3-Hydroxypimeloyl-CoA C06723 6-Carboxyhex-2-enoyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 66 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- C07083 Styrene C07111 Ethylbenzene C07112 1-Phenylethanol C11348 S-1-Phenylethanol Consensus scope of cluster 67 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12415 Nogalonicacidmethylester C12417 Auraviketone C12418 Dihydro-NAME C12419 Auramycinone Consensus scope of cluster 68 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06082 Abscisate C13454 Xanthoxicacid C13455 Abscisicaldehyde C13456 Abscisicalcohol Consensus scope of cluster 69 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C13620 TetrabromobisphenolA C13621 TribromobisphenolA C13622 DibromobisphenolA C13623 MonobromobisphenolA C13624 BisphenolA C13645 Hydrobromicacid Consensus scope of cluster 70 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14116 Naphthyl-2-methyl-succinyl-CoA C14117 Naphthyl-2-methylene-succinyl-CoA C14118 Naphthyl-2-hydroxymethyl-succinylCoA C14119 Naphthyl-2-oxomethyl-succinyl-CoA Consensus scope of cluster 71 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00536 Triphosphate C00704 O2.- C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01146 2-Hydroxy-3-oxopropanoate C01180 4-Methylthio-2-oxobutanoicacid C01353 Carbonicacid C02466 Trimetaphosphate C03459 2-Hydroxy-3-oxosuccinate C04188 S-Methyl-5-thio-D-ribose1-phosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C08276 3-Methylthiopropionicacid C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate Consensus scope of cluster 72 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04525 Fecosterol C15777 Episterol C15780 5-Dehydroepisterol C15781 24-Methylenecholesterol Consensus scope of cluster 73 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15900 Spheroidene C15902 Hydroxyspheroidene C15903 Spheroidenone C15905 Hydroxyspheroidenone Consensus scope of cluster 74 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01056 S-6-Hydroxynicotine C01297 6-Hydroxypseudooxynicotine C03043 R-6-Hydroxynicotine C03056 2,6-Dihydroxypyridine C15986 2,6-Dihydroxypseudooxynicotine C15987 4-Methylaminobutyrate Consensus scope of cluster 75 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05418 Cholesterol-5beta,6beta-epoxide C05419 Cholesterol-5alpha,6beta-epoxide C05425 3beta,5alpha,6beta-Cholestanetriol C15992 Cholesterol-5alpha,6alpha-epoxide Consensus scope of cluster 76 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00115 Chloride C00704 O2.- C01327 HCl C01407 Benzene C01486 Chlorite C06988 beta-1,2,3,4,5,6-Hexachlorocyclohexane C06989 delta-3,4,5,6-Tetrachlorocyclohexene C06990 Chlorobenzene C11352 5,6-Dichloro-1,3-cyclohexadiene C16181 beta-2,3,4,5,6-Pentachlorocyclohexanol C16182 beta-2,3,5,6-Tetrachloro-1,4-cyclohexanediol Consensus scope of cluster 77 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14315 Anthracene C16205 Anthracene-9,10-dihydrodiol C16206 9,10-Dihydroxyanthracene C16207 9,10-Anthraquinone Consensus scope of cluster 78 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00786 --Vestitone C10503 --Medicarpin C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16225 --Vestitol Consensus scope of cluster 79 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16407 2',4,4',6'-Tetrahydroxychalcone4'-O-glucoside C16408 2',3,4,4',6'-Peptahydroxychalcone4'-O-glucoside C16409 Aureusidin6-O-glucoside C16410 Bracteatin6-O-glucoside Consensus scope of cluster 80 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00121 D-Ribose C00216 D-Arabinose C00309 D-Ribulose C00704 O2.- Consensus scope of cluster 81 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00181 D-Xylose C00310 D-Xylulose C00476 D-Lyxose C00704 O2.- Consensus scope of cluster 82 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00033 Acetate C00080 H+ C00088 Nitrite C00134 Putrescine C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00315 Spermidine C00555 4-Aminobutanal C00612 N1-Acetylspermidine C00697 Nitrogen C00704 O2.- C00986 1,3-Diaminopropane C01029 N8-Acetylspermidine C02714 N-Acetylputrescine C05359 e- C05360 Diimine C05361 Hydrazine C05665 beta-Aminopropionaldehyde C05936 N4-Acetylaminobutanal C06244 Acetamide C06366 Homospermidine C15668 1-Pyrroline Consensus scope of cluster 83 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00058 Formate C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00488 Formamide C00697 Nitrogen C00704 O2.- C01326 Hydrogencyanide C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 84 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00507 L-Rhamnose C00704 O2.- C00861 L-Rhamnulose C02431 L-Rhamnofuranose Consensus scope of cluster 85 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00479 Propanal C00583 Propane-1,2-diol C00704 O2.- C02948 4-Hydroxyhexan-3-one Consensus scope of cluster 86 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00495 Sulochrin C00704 O2.- C03036 +-Bisdechlorogeodin C03040 --Bisdechlorogeodin Consensus scope of cluster 87 C00001 H2O C00007 Oxygen C00027 H2O2 C00058 Formate C00080 H+ C00101 Tetrahydrofolate C00234 10-Formyltetrahydrofolate C00445 5,10-Methenyltetrahydrofolate C00704 O2.- C03479 5-Formyltetrahydrofolate Consensus scope of cluster 88 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00193 Aromaticaldehyde C00539 Aromaticacid C00704 O2.- C03485 Aromaticprimaryalcohol Consensus scope of cluster 89 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00031 D-Glucose C00059 Sulfate C00080 H+ C00087 Sulfur C00088 Nitrite C00089 Sucrose C00094 Sulfite C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00192 Hydroxylamine C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00244 Nitrate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00282 Hydrogen C00283 Hydrogensulfide C00320 Thiosulfate C00329 D-Glucosamine C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00697 Nitrogen C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C01075 N-Sulfo-D-glucosamine C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01742 Palatinose C01861 Trithionate C02013 Cellotetraose C02336 beta-D-Fructose C02779 2-Dehydro-D-glucose C02827 D-Glucose6-sulfate C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C03752 2-Amino-2-deoxy-D-gluconate C03789 N,6-O-Disulfo-D-glucosamine C05359 e- C05360 Diimine C05361 Hydrazine C05383 Aminosugars C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone C11481 HSO3- Consensus scope of cluster 90 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00408 L-Pipecolate C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00704 O2.- C04076 L-2-Aminoadipate6-semialdehyde Consensus scope of cluster 91 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00141 3-Methyl-2-oxobutanoicacid C00704 O2.- C04039 2,3-Dihydroxy-3-methylbutanoate C04272 R-2,3-Dihydroxy-3-methylbutanoate Consensus scope of cluster 92 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00811 4-Coumarate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01197 3,4-Dihydroxy-trans-cinnamate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C04366 3-2-Carboxyethenyl-cis,cis-muconate C05627 4-Hydroxystyrene C06224 3,4-Dihydroxystyrene Consensus scope of cluster 93 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02504 2S-2-Isopropylmalate C02631 2-Isopropylmaleate C04411 2R,3S-3-Isopropylmalate Consensus scope of cluster 94 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04174 trans-2-Decenoyl-acyl-carrierprotein C04180 cis-3-Decenoyl-acyl-carrierprotein C04619 3R-3-Hydroxydecanoyl-acyl-carrierprotein Consensus scope of cluster 95 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02741 Phosphoribosyl-AMP C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05569 5'-Phospho-D-1-ribulosylformimine Consensus scope of cluster 96 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02944 3-cis-Dodecenoyl-CoA C03221 2-trans-Dodecenoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA Consensus scope of cluster 97 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00633 4-Hydroxybenzaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03198 S-4-Hydroxymandelate C03459 2-Hydroxy-3-oxosuccinate C03590 4-Hydroxyphenylglyoxylate C05343 R-4-Hydroxymandelate Consensus scope of cluster 98 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05417 5,6beta-Epoxy-5beta-cholestane C05423 5,6beta-Epoxy-5alpha-cholestane C05424 5alpha-Cholestan-5,6beta-diol Consensus scope of cluster 99 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01694 Ergosterol C04416 5alpha-Ergosta-7,22-diene-3beta,5-diol C05441 VitaminD2 Consensus scope of cluster 100 C00001 H2O C00007 Oxygen C00027 H2O2 C00033 Acetate C00080 H+ C00146 Phenol C00548 Phenylacetate C00704 O2.- C01866 beta-Lactam C02954 6-Aminopenicillanate C03806 Substitutedbeta-aminoacid C05551 PenicillinG Consensus scope of cluster 101 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01111 7,8-Dihydroxykynurenate C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate Consensus scope of cluster 102 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C00780 3-2-Aminoethyl-1H-indol-5-ol C05359 e- C05360 Diimine C05361 Hydrazine C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate C05647 Formyl-5-hydroxykynurenamine Consensus scope of cluster 103 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01251 2-Hydroxybutane-1,2,4-tricarboxylate C04002 But-1-ene-1,2,4-tricarboxylate C05662 Homoisocitrate Consensus scope of cluster 104 C00001 H2O C00007 Oxygen C00010 CoA C00027 H2O2 C00080 H+ C00704 O2.- C00827 Lactoyl-CoA C00894 Propenoyl-CoA C01013 3-Hydroxypropanoate C05668 3-Hydroxypropionyl-CoA Consensus scope of cluster 105 C00001 H2O C00007 Oxygen C00027 H2O2 C00032 Heme C00080 H+ C00704 O2.- C01079 ProtoporphyrinogenIX C01708 Hemoglobin C02191 Protoporphyrin C05781 Oxyhemoglobin C05782 Myoglobin C05783 Cytochromea C05784 Catalase C05785 Peroxidase C06258 Globin C14818 Fe2+ C14819 Fe3+ Consensus scope of cluster 106 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00378 Thiamin C00704 O2.- C01279 4-Amino-5-hydroxymethyl-2-methylpyrimidine C02892 Thiaminaceticacid C04294 5-2-Hydroxyethyl-4-methylthiazole C05856 Thiaminealdehyde Consensus scope of cluster 107 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00116 Glycerol C00704 O2.- C00969 3-Hydroxypropanal C05999 Lactaldehyde Consensus scope of cluster 108 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01880 6-Hexanolide C06101 Hexan-1-ol-6-oate C06103 6-Hydroxyhexanoicacid Consensus scope of cluster 109 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine C06162 Sanguinarine Consensus scope of cluster 110 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00755 4-Hydroxy-3-methoxy-benzaldehyde C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C06317 4-Hydroxy-3-methoxy-benzenemethanol Consensus scope of cluster 111 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05556 deltaL-2-Aminoadipyl-L-cysteinyl-D-valine C05557 IsopenicillinN C06564 PenicillinN Consensus scope of cluster 112 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C06639 2,2-Bis4'-chlorophenylethanol C06640 Bis4'-chlorophenylacetate C06641 Bis4'-chlorophenylmethane C06642 unsym-Bis4'-chlorophenylethylene Consensus scope of cluster 113 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00115 Chloride C00704 O2.- C01486 Chlorite C04596 1,1-Dichloro-2,2-bis4-chlorophenylethylene C06637 1-Chloro-2,2-bis4'-chlorophenylethylene C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate C06646 2-4'-Chlorophenyl-3,3-dichloropropenoate C11353 2-Hydroxy-3-chloropenta-2,4-dienoate Consensus scope of cluster 114 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06674 4-Sulfocatechol C06675 3-Sulfomuconate C06676 4-Sulfolactone Consensus scope of cluster 115 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene Consensus scope of cluster 116 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C00704 O2.- C04483 3alpha,12alpha-Dihydroxy-5beta-cholanate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate Consensus scope of cluster 117 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07271 Limonene-1,2-epoxide C07276 Limonene-1,2-diol C11937 1S,4R-1-Hydroxy-2-oxolimonene Consensus scope of cluster 118 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09880 alpha-Pinene C09884 Pinocarvone C11941 Pinocarveol Consensus scope of cluster 119 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11945 trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11946 cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11947 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA Consensus scope of cluster 120 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12107 AHBA C12108 AminoDHS C12109 AminoDHQ Consensus scope of cluster 121 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12322 dTDP-L-vancosamine Consensus scope of cluster 122 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12422 Aklanonicacidmethylester C12423 Aklaviketone C12424 Aklavinone Consensus scope of cluster 123 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01907 Daunorubicin C12430 13-Dihydrodaunorubicin C12433 13S-13-Dihydrodaunorubicin Consensus scope of cluster 124 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14101 2-Naphthoicacid C14111 5,6,7,8-Tetrahydro-2-naphthoicacid C14113 Decahydro-2-naphthoicacid Consensus scope of cluster 125 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12176 ProansamycinX C12246 ProtorifamycinI C14721 34a-Deoxy-rifamycinW Consensus scope of cluster 126 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14722 RifamycinW-hemiacetal C14724 Demethyl-desacetyl-rifamycinS C14725 Demethyl-desacetyl-rifamycinSV Consensus scope of cluster 127 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06314 LipoxinA4 C06315 LipoxinB4 C14815 5,6-Epoxytetraene Consensus scope of cluster 128 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14840 Bromobenzene-2,3-oxide C14841 2-Bromophenol C14842 Bromobenzene-2,3-dihydrodiol Consensus scope of cluster 129 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14871 S-Formylmethylglutathione C14874 Glutathioneepisulfoniumion C14875 S-2-Hydroxyethylglutathione Consensus scope of cluster 130 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C08821 Isofucosterol C15782 delta7-Avenasterol C15783 5-Dehydroavenasterol Consensus scope of cluster 131 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15881 Spirilloxanthin C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin Consensus scope of cluster 132 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09707 Phaseicacid C15514 8'-Hydroxyabscisate C15971 Dihydrophaseicacid Consensus scope of cluster 133 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C02505 2-Phenylacetamide C05359 e- C05360 Diimine C05361 Hydrazine C07086 Phenylaceticacid C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime Consensus scope of cluster 134 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16277 R.g.-KetoI C16279 Thiothece-474 C16280 Okenone Consensus scope of cluster 135 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C07481 Caffeine C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea Consensus scope of cluster 136 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00125 Ferricytochromec C00126 Ferrocytochromec C00704 O2.- Consensus scope of cluster 137 C00001 H2O C00007 Oxygen C00027 H2O2 C00058 Formate C00067 Formaldehyde C00080 H+ C00132 Methanol C00704 O2.- Consensus scope of cluster 138 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00134 Putrescine C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00315 Spermidine C00555 4-Aminobutanal C00697 Nitrogen C00704 O2.- C00986 1,3-Diaminopropane C05359 e- C05360 Diimine C05361 Hydrazine C05665 beta-Aminopropionaldehyde C06366 Homospermidine C15668 1-Pyrroline Consensus scope of cluster 139 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00154 Palmitoyl-CoA C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00249 Hexadecanoicacid C00266 Glycolaldehyde C00313 Oxalyl-CoA C00704 O2.- C00798 Formyl-CoA C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01948 Pentadecanal C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 140 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00019 S-Adenosyl-L-methionine C00021 S-Adenosyl-L-homocysteine C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00051 Glutathione C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00073 L-Methionine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00088 Nitrite C00090 Catechol C00097 L-Cysteine C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00113 PQQ C00121 D-Ribose C00122 Fumarate C00127 Glutathionedisulfide C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00155 L-Homocysteine C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00170 5'-Methylthioadenosine C00177 Cyanide C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00242 Guanine C00244 Nitrate C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00282 Hydrogen C00283 Hydrogensulfide C00288 HCO3- C00292 Aniline C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00302 Glutamate C00309 D-Ribulose C00311 Isocitrate C00315 Spermidine C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00409 Methanethiol C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00441 L-Aspartate4-semialdehyde C00463 Indole C00469 Ethanol C00472 p-Benzoquinone C00475 Cytidine C00483 Tyramine C00488 Formamide C00490 Itaconate C00491 L-Cystine C00493 Shikimate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00519 Hypotaurine C00526 Deoxyuridine C00530 p-Benzenediol C00542 Cystathionine C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00612 N1-Acetylspermidine C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00697 Nitrogen C00704 O2.- C00711 Malate C00716 Serine C00719 Betaine C00736 Cysteine C00740 D-Serine C00745 Nicotine C00750 Spermine C00757 Berberine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00855 D-Methionine C00878 D-Arabinonate C00879 D-Galactarate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00928 Mercaptoethanol C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00957 Mercaptopyruvate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00979 O-Acetyl-L-serine C00986 1,3-Diaminopropane C00993 D-Alanyl-D-alanine C01004 N-Methylnicotinate C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01029 N8-Acetylspermidine C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01077 O-Acetyl-L-homoserine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01137 S-Adenosylmethioninamine C01146 2-Hydroxy-3-oxopropanoate C01152 Npi-Methyl-L-histidine C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01180 4-Methylthio-2-oxobutanoicacid C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01262 beta-Alanyl-Npi-methyl-L-histidine C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01328 HO- C01353 Carbonicacid C01359 PQQH2 C01384 Maleicacid C01401 Alanine C01403 Anisole C01405 Aspirin C01417 Cyanate C01419 Cys-Gly C01420 Cystine C01424 Gallate C01456 Tropate C01468 4-Cresol C01494 Ferulate C01502 o-Methoxyphenol C01537 Urethane C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01667 Bacitracin C01678 Cysteamine C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01752 Scopoletin C01755 Thiocyanate C01762 Xanthosine C01769 S-Acetoin C01795 Columbamine C01817 Homocystine C01837 Nitroethane C01888 Aminoacetone C01962 Thiocysteine C01987 2-Aminophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C02083 Styreneoxide C02091 Ureidoglycine C02105 S-Reticuline C02106 S-Scoulerine C02107 S,S-Tartaricacid C02116 2-Nitropropane C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02291 L-Cystathionine C02294 Methylguanidine C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02442 N-Methyltyramine C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02564 N-Feruloylglycine C02565 N-Methylhydantoin C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02723 N-Methylputrescine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02890 Tetrahydropalmatine C02916 S-Norlaudanosoline C02918 1-Methylnicotinamide C02923 2,3-Dihydroxytoluene C02926 2-Aminobutan-4-olide C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02983 L-2-Methyltryptophan C03005 N-Methylanthranilate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03089 5-Methylthio-D-ribose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03145 N-Formyl-L-methionine C03150 N-Ribosylnicotinamide C03172 S-Methyl-L-methionine C03174 S-Succinylglutathione C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03329 S-Canadine C03340 L-2,3-Dihydrodipicolinate C03354 3-Methylthiopropanamine C03375 Bis3-aminopropylamine C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03431 S-Inosyl-L-homocysteine C03440 cis-4-Hydroxy-D-proline C03451 R-S-Lactoylglutathione C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03508 L-2-Amino-3-oxobutanoicacid C03539 S-Ribosyl-L-homocysteine C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03584 3-Uracil-1-yl-L-alanine C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03914 S-beta-Methylindolepyruvate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C03986 3-Hydroxy-4-methylanthranilate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04118 5,8,13,13a-Tetrahydrocolumbamine C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05127 N-Methylhistamine C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05176 S-N-Methylcoclaurine C05202 3'-Hydroxy-N-methyl-S-coclaurine C05239 5-Aminoimidazole C05315 Palmatine C05324 Nicotianamine C05330 Homocysteine C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05524 Aminoacyl-L-methionine C05527 3-Sulfinylpyruvate C05532 SO2 C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05581 3-Methoxy-4-hydroxyphenylacetaldehyde C05585 Gentisatealdehyde C05587 3-Methoxytyramine C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05640 Cinnavalininate C05644 3-Methylindolepyruvate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05658 Indoxyl C05665 beta-Aminopropionaldehyde C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05717 alpha-Amino-gamma-cyanobutanoate C05730 Glutathionylspermidine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05827 Methylimidazoleacetaldehyde C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06114 gamma-Glutamyl-beta-aminopropiononitrile C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06160 S-Norcoclaurine C06161 S-Coclaurine C06178 1-Methylpyrrolinium C06195 Imidazolone C06199 Hordenine C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06213 N-Methyltryptamine C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06517 S-6-O-Methylnorlaudanosoline C06518 S-Nororientaline C06519 S-3'-Hydroxycoclaurine C06520 S-Norreticuline C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06986 Spirodilactone C07086 Phenylaceticacid C07103 2-Hydroxy-1,4-benzoquinone C07272 Maleimide C07331 Carbonylsulfide C07480 Theobromine C07481 Caffeine C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08276 3-Methylthiopropionicacid C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C09306 Sulfurdioxide C10974 4-Methylaminobutanal C11355 4-Amino-4-deoxychorismate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11514 E-3-Methoxycarbonylpent-2-enedioate C11515 E-2-Methoxycarbonylmethylbutenedioate C11527 4-Hydroxymandelate C11631 9-Riburonosylhypoxanthine C11821 5-Hydroxyisourate C11838 S-4,5-dihydroxypentan-2,3-dione C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13747 1,7-Dimethylxanthine C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14180 S-Hydroxymethylglutathione C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15486 3''-Deamino-3''-oxonicotianamine C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15526 3-Methylhistamine C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C15809 Iminoglycine C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate C16352 7-Methylxanthosine C16353 7-Methylxanthine C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea Consensus scope of cluster 141 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00058 Formate C00067 Formaldehyde C00080 H+ C00088 Nitrite C00132 Methanol C00192 Hydroxylamine C00218 Methylamine C00244 Nitrate C00282 Hydrogen C00488 Formamide C00697 Nitrogen C00704 O2.- C01326 Hydrogencyanide C01585 Hexanoicacid C02722 N-Methylhexanamide C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 142 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00247 L-Sorbose C00273 5-Dehydro-D-fructose C00704 O2.- Consensus scope of cluster 143 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00340 Reducedrubredoxin C00435 Oxidizedrubredoxin C00704 O2.- Consensus scope of cluster 144 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00486 Bilirubin C00500 Biliverdin C00704 O2.- Consensus scope of cluster 145 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00259 L-Arabinose C00508 L-Ribulose C00704 O2.- Consensus scope of cluster 146 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00114 Choline C00576 Betainealdehyde C00704 O2.- Consensus scope of cluster 147 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00187 Cholesterol C00599 Cholest-4-en-3-one C00704 O2.- Consensus scope of cluster 148 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00018 Pyridoxalphosphate C00027 H2O2 C00080 H+ C00250 Pyridoxal C00314 Pyridoxine C00536 Triphosphate C00627 Pyridoxinephosphate C00704 O2.- C00847 4-Pyridoxate C00971 4-Pyridoxolactone C02466 Trimetaphosphate C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal C11437 1-Deoxy-D-xylulose5-phosphate C11638 3-Amino-2-oxopropylphosphate Consensus scope of cluster 149 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00473 Retinol C00704 O2.- C00899 11-cis-Retinol Consensus scope of cluster 150 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00536 Triphosphate C00704 O2.- C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02466 Trimetaphosphate C03459 2-Hydroxy-3-oxosuccinate C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol Consensus scope of cluster 151 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00997 Ferricytochromec2 C01000 Ferrocytochromec2 Consensus scope of cluster 152 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00619 3-Oxo-delta4-steroid C00704 O2.- C01034 3-Oxo-delta5-steroid Consensus scope of cluster 153 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01097 D-Tagatose6-phosphate C01113 D-Galactose6-phosphate Consensus scope of cluster 154 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00779 Scytalone C01173 1,3,8-Naphthalenertriol Consensus scope of cluster 155 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00501 CDP-glucose C00704 O2.- C01219 CDP-4-dehydro-6-deoxy-D-glucose Consensus scope of cluster 156 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00708 Iodide C01382 Iodine Consensus scope of cluster 157 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00379 Xylitol C00704 O2.- C01394 Xylose Consensus scope of cluster 158 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00261 Benzaldehyde C00704 O2.- C01408 Benzoin Consensus scope of cluster 159 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00423 trans-Cinnamate C00704 O2.- C01456 Tropate Consensus scope of cluster 160 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00115 Chloride C00704 O2.- C01486 Chlorite Consensus scope of cluster 161 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00312 L-Xylulose C00704 O2.- C01508 L-Lyxose Consensus scope of cluster 162 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00704 O2.- C01548 Acetylene Consensus scope of cluster 163 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00519 Hypotaurine C00704 O2.- C01678 Cysteamine Consensus scope of cluster 164 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01717 4-Hydroxy-2-quinolinecarboxylicacid Consensus scope of cluster 165 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01019 6-Deoxy-L-galactose C01721 L-Fuculose Consensus scope of cluster 166 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01494 Ferulate C01752 Scopoletin Consensus scope of cluster 167 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00810 R-Acetoin C01769 S-Acetoin Consensus scope of cluster 168 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01848 RifamycinB C01849 RifamycinO Consensus scope of cluster 169 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00927 IsonocardicinA C01941 NocardicinA Consensus scope of cluster 170 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00897 alpha-Maltose C01971 beta-Maltose Consensus scope of cluster 171 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01983 R-Mandelate C01984 S-Mandelate Consensus scope of cluster 172 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00511 Propenoate C00697 Nitrogen C00704 O2.- C01659 Acrylamide C01998 Acrylonitrile C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 173 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00423 trans-Cinnamate C00704 O2.- C00729 Tropine C01456 Tropate C01479 Atropine C02046 L-Hyoscyamine Consensus scope of cluster 174 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00601 Phenylacetaldehyde C00704 O2.- C02083 Styreneoxide Consensus scope of cluster 175 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02105 S-Reticuline C02106 S-Scoulerine Consensus scope of cluster 176 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01066 Cyclohexane-1,3-dione C02129 5-Oxohexanoicacid Consensus scope of cluster 177 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01943 Obtusifoliol C02141 Cycloeucalenol Consensus scope of cluster 178 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01351 Donor C02177 Oxidizeddonor Consensus scope of cluster 179 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01079 ProtoporphyrinogenIX C02191 Protoporphyrin Consensus scope of cluster 180 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01198 3-2-Hydroxyphenylpropanoate C02274 Dihydrocoumarin Consensus scope of cluster 181 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01951 Piperitenone C02289 Isopiperitenone Consensus scope of cluster 182 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02172 N-Acetylisatin C02298 N-Acetylindoxyl Consensus scope of cluster 183 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00472 p-Benzoquinone C00530 p-Benzenediol C00697 Nitrogen C00704 O2.- C02222 2-Maleylacetate C02235 4-Nitrocatechol C02372 4-Hydroxyaniline C02814 Benzene-1,2,4-triol C03676 3-Hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C05359 e- C05360 Diimine C05361 Hydrazine C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C12838 trans-4-Carboxymethylenebut-2-en-4-olide Consensus scope of cluster 184 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01785 Benzenediol C02389 Benzosemiquinone Consensus scope of cluster 185 C00001 H2O C00007 Oxygen C00027 H2O2 C00032 Heme C00080 H+ C00524 Cytochromec C00704 O2.- C01079 ProtoporphyrinogenIX C02191 Protoporphyrin C02248 Apocytochromec C02416 Holocytochromec C05783 Cytochromea C05784 Catalase C05785 Peroxidase C14818 Fe2+ C14819 Fe3+ Consensus scope of cluster 186 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02200 UDP-glucosamine C02467 UDP-galactosamine Consensus scope of cluster 187 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00123 L-Leucine C00704 O2.- C02486 3R-beta-Leucine Consensus scope of cluster 188 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00477 Ecdysone C00704 O2.- C02513 3-Dehydroecdysone Consensus scope of cluster 189 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01590 Kievitone C02549 Kievitonehydrate Consensus scope of cluster 190 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01757 Triacetate C02752 Triacetatelactone Consensus scope of cluster 191 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02037 Glycylglycine C02777 2,5-Dioxopiperazine Consensus scope of cluster 192 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00727 Orcinol C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01839 Orsellinate C02868 Orsellinatedepside C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 193 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01863 Xanthoaphin C02879 Protoaphinaglucone Consensus scope of cluster 194 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00115 Chloride C00146 Phenol C00156 4-Hydroxybenzoate C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00313 Oxalyl-CoA C00704 O2.- C00798 Formyl-CoA C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01486 Chlorite C02370 4-Chlorobenzoate C02949 4-Hydroxybenzoyl-CoA C03459 2-Hydroxy-3-oxosuccinate C06387 4-Chlorobenzoyl-CoA C06648 4-Chlorobenzaldehyde C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol Consensus scope of cluster 195 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02117 2-Oxophytanate C02982 L-2-Hydroxyphytanate Consensus scope of cluster 196 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01090 16alpha-Hydroxysteroid C03050 16beta-Hydroxysteroid Consensus scope of cluster 197 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00877 Crotonoyl-CoA C00975 Dihydroxyfumarate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02331 Vinylacetyl-CoA C02411 Glutaconyl-1-CoA C03058 2-Hydroxyglutaryl-CoA C03459 2-Hydroxy-3-oxosuccinate C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Consensus scope of cluster 198 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02660 Benzylthiocyanate C03098 Benzylisothiocyanate Consensus scope of cluster 199 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00712 9Z-Octadecenoicacid C03195 R-10-Hydroxystearate Consensus scope of cluster 200 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01126 2-trans,6-trans-Farnesol C03220 2-cis,6-trans-Farnesol Consensus scope of cluster 201 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03178 Tetrahydroxypteridine C03314 Xanthine-8-carboxylate Consensus scope of cluster 202 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00137 myo-Inositol C00191 D-Glucuronate C00486 Bilirubin C00500 Biliverdin C00704 O2.- C00905 D-Fructuronate C02670 D-Glucuronolactone C03374 Bilirubin-glucuronoside C03387 D-Glucurono-6,2-lactone C05787 Bilirubinbeta-diglucuronide C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen C05793 L-Urobilin C05794 I-Urobilin C05795 D-Urobilin Consensus scope of cluster 203 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03319 dTDP-6-deoxy-L-mannose C03442 dTDP-L-dihydrostreptose Consensus scope of cluster 204 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00249 Hexadecanoicacid C00266 Glycolaldehyde C00473 Retinol C00704 O2.- C00899 11-cis-Retinol C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01948 Pentadecanal C02588 Retinylpalmitate C03455 11-cis-Retinylpalmitate C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 205 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01593 Limonoate C03514 LimonoateD-ring-lactone Consensus scope of cluster 206 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00014 NH3 C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00088 Nitrite C00189 Ethanolamine C00192 Hydroxylamine C00244 Nitrate C00266 Glycolaldehyde C00282 Hydrogen C00346 Ethanolaminephosphate C00536 Triphosphate C00697 Nitrogen C00704 O2.- C01548 Acetylene C01837 Nitroethane C02466 Trimetaphosphate C03167 Phosphonoacetaldehyde C03557 2-Aminoethylphosphonate C05359 e- C05360 Diimine C05361 Hydrazine C06771 Triethanolamine C06772 Diethanolamine Consensus scope of cluster 207 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01775 Actinomycin C03597 Actinomycinicmonolactone Consensus scope of cluster 208 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose Consensus scope of cluster 209 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01171 alpha-D-Hexose1-phosphate C03735 alpha-D-Hexose6-phosphate Consensus scope of cluster 210 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03207 16-Dehydroprogesterone C03748 16alpha-Hydroxyprogesterone Consensus scope of cluster 211 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01720 L-Fuconate C03827 2-Dehydro-3-deoxy-L-fuconate Consensus scope of cluster 212 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01189 5alpha-Cholest-7-en-3beta-ol C03845 5alpha-Cholest-8-en-3beta-ol Consensus scope of cluster 213 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01165 L-Glutamate5-semialdehyde C03912 S-1-Pyrroline-5-carboxylate Consensus scope of cluster 214 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03871 L-2-Amino-6-oxoheptanedioate C03972 2,3,4,5-Tetrahydrodipicolinate Consensus scope of cluster 215 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03239 6-Amino-2-oxohexanoate C04092 delta1-Piperideine-2-carboxylate Consensus scope of cluster 216 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03205 11-Deoxycorticosterone C04108 20-Hydroxy-3-oxopregn-4-en-21-al Consensus scope of cluster 217 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00318 L-Carnitine C00704 O2.- C04114 4-Trimethylammoniobut-2-enoate Consensus scope of cluster 218 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04073 Heparosan-N-sulfateL-iduronate C04196 Heparosan-N-sulfateD-glucuronate Consensus scope of cluster 219 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00483 Tyramine C00697 Nitrogen C00704 O2.- C03765 4-Hydroxyphenylacetaldehyde C04227 1-4-Hydroxyphenyl-2-aminoethanol C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 220 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02027 Deoxylimonate C04251 DeoxylimononicacidD-ring-lactone Consensus scope of cluster 221 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03356 3-Phospho-D-erythronate C04309 Phosphoenol-4-deoxy-3-tetrulosonate Consensus scope of cluster 222 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01274 5-Formyl-5,6,7,8-tetrahydromethanopterin C04330 5,10-Methenyltetrahydromethanopterin Consensus scope of cluster 223 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01711 Inulobiose C04333 Bis-D-fructose2',1:2,1'-dianhydride Consensus scope of cluster 224 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02759 alpha-Pinene-oxide C04435 Z-2-Methyl-5-isopropylhexa-2,5-dienal Consensus scope of cluster 225 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01089 R-3-Hydroxybutanoate C04546 R-3-R-3-Hydroxybutanoyloxybutanoate Consensus scope of cluster 226 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00451 1R,2S-1-Hydroxypropane-1,2,3-tricarboxylate C00704 O2.- C04617 1S,2S-1-Hydroxypropane-1,2,3-tricarboxylate Consensus scope of cluster 227 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04621 E-2-2-Furyl-3-5-nitro-2-furylacrylamide C04622 Z-2-2-Furyl-3-5-nitro-2-furylacrylamide Consensus scope of cluster 228 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01161 3,4-Dihydroxyphenylacetate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde Consensus scope of cluster 229 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01267 3-Imidazol-4-yl-2-oxopropylphosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate Consensus scope of cluster 230 C00001 H2O C00007 Oxygen C00027 H2O2 C00033 Acetate C00080 H+ C00704 O2.- C01291 3-4-Methylpent-3-en-1-yl-pent-2-enedioyl-CoA C03685 7-Methyl-3-oxooctanoyl-CoA C04675 3-Hydroxy-3-4-methylpent-3-en-1-ylglutaryl-CoA Consensus scope of cluster 231 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01618 Testolate C04676 Testololactone Consensus scope of cluster 232 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04685 13E-15S-15-Hydroxy-9-oxoprosta-10,13-dienoate C04686 13E-15S-15-Hydroxy-9-oxoprosta-11,13-dienoate Consensus scope of cluster 233 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04793 3,4-Dihydroxy-9,10-secoandrosta-1,3,510-triene-9,17-dione C04844 3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-110,2-dien-4-oate Consensus scope of cluster 234 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04843 5Z,9E,14Z-8xi,11xi,12S-8,11,12-Trihydroxyicosa-5,9,14-trienoate C04849 5Z,9E,14Z-8xi,11R,12S-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoicacid Consensus scope of cluster 235 C00001 H2O C00007 Oxygen C00027 H2O2 C00059 Sulfate C00080 H+ C00087 Sulfur C00094 Sulfite C00283 Hydrogensulfide C00320 Thiosulfate C00704 O2.- C01310 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine C01861 Trithionate C04864 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine4-sulfate C04865 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine6-sulfate C11481 HSO3- Consensus scope of cluster 236 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05110 4alpha-Methylcholesta-8-en-3beta-ol C05111 Methostenol Consensus scope of cluster 237 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04027 delta1-Pyrroline2-carboxylate C05147 trans-L-3-Hydroxyproline Consensus scope of cluster 238 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04798 5-Amino-4-chloro-2-2,3-dihydroxyphenyl-32H-pyridazinone C05155 5-Amino-4-chloro-2-2-hydroxymuconoyl-32H-pyridazinone Consensus scope of cluster 239 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05176 S-N-Methylcoclaurine C05202 3'-Hydroxy-N-methyl-S-coclaurine Consensus scope of cluster 240 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05229 Phaseollidinhydrate C05230 Phaseollidin Consensus scope of cluster 241 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05268 S-Hydroxyhexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA Consensus scope of cluster 242 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05258 S-3-Hydroxyhexadecanoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA Consensus scope of cluster 243 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05260 S-3-Hydroxytetradecanoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA Consensus scope of cluster 244 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05264 S-Hydroxydecanoyl-CoA C05275 trans-Dec-2-enoyl-CoA Consensus scope of cluster 245 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05266 S-Hydroxyoctanoyl-CoA C05276 trans-Oct-2-enoyl-CoA Consensus scope of cluster 246 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05277 S-3-Hydroxycapryloyl-CoA C05278 R-3-Hydroxycapryloyl-CoA Consensus scope of cluster 247 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05279 trans,cis-Lauro-2,6-dienoyl-CoA C05280 cis,cis-3,6-Dodecadienoyl-CoA Consensus scope of cluster 248 C00001 H2O C00007 Oxygen C00027 H2O2 C00058 Formate C00080 H+ C00704 O2.- C00951 Estradiol-17beta C05294 19-Hydroxytestosterone C05295 19-Oxotestosterone Consensus scope of cluster 249 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00033 Acetate C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00601 Phenylacetaldehyde C00697 Nitrogen C00704 O2.- C02083 Styreneoxide C05332 Phenethylamine C05359 e- C05360 Diimine C05361 Hydrazine C06244 Acetamide C06746 N-Acetylphenylethylamine Consensus scope of cluster 250 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- Consensus scope of cluster 251 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- C05413 Phytoene C05414 Phytofluene C05430 zeta-Carotene Consensus scope of cluster 252 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05437 Zymosterol C05439 5alpha-Cholesta-7,24-dien-3beta-ol Consensus scope of cluster 253 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01753 Sitosterol C05442 Stigmasterol Consensus scope of cluster 254 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01164 Cholesta-5,7-dien-3beta-ol C05443 VitaminD3 Consensus scope of cluster 255 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05447 3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA C05448 3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA Consensus scope of cluster 256 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05450 3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA C05460 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA Consensus scope of cluster 257 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00245 Taurine C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C00704 O2.- C04483 3alpha,12alpha-Dihydroxy-5beta-cholanate C05122 Taurocholate C05463 Taurodeoxycholate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate Consensus scope of cluster 258 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00487 Carnitine C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02224 2-Methylcholine C03459 2-Hydroxy-3-oxosuccinate C05543 3-Dehydroxycarnitine Consensus scope of cluster 259 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate Consensus scope of cluster 260 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01598 Melatonin C05642 Formyl-N-acetyl-5-methoxykynurenamine Consensus scope of cluster 261 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02470 Xanthurenicacid C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate Consensus scope of cluster 262 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05652 4-2-Amino-5-hydroxyphenyl-2,4-dioxobutanoate C05663 6-Hydroxykynurenate Consensus scope of cluster 263 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05677 Lipophosphonoglycan C05678 1-Hydroxy-2-aminoethylphosphonate Consensus scope of cluster 264 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00033 Acetate C00080 H+ C00227 Acetylphosphate C00536 Triphosphate C00704 O2.- C02466 Trimetaphosphate C05682 Phosphonoacetate Consensus scope of cluster 265 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05688 Selenocysteine C05704 Selenocystine Consensus scope of cluster 266 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05698 Selenohomocysteine C05707 Selenohomocystine Consensus scope of cluster 267 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05802 2-Hexaprenyl-6-methoxyphenol C05803 2-Hexaprenyl-6-methoxy-1,4-benzoquinone Consensus scope of cluster 268 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01328 HO- C02730 2-Succinylbenzoate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C06986 Spirodilactone Consensus scope of cluster 269 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05838 cis-2-Hydroxycinnamate C05851 Coumarin Consensus scope of cluster 270 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C05938 L-4-Hydroxyglutamatesemialdehyde Consensus scope of cluster 271 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03069 3-Methylcrotonyl-CoA C05998 3-Hydroxyisovaleryl-CoA Consensus scope of cluster 272 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02170 Methylmalonate C06002 S-Methylmalonatesemialdehyde Consensus scope of cluster 273 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00671 S-3-Methyl-2-oxopentanoicacid C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02223 2-Methylbutanal C03459 2-Hydroxy-3-oxosuccinate C06007 R-2,3-Dihydroxy-3-methylpentanoate Consensus scope of cluster 274 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04773 3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate C06052 5-Pyridoxolactone Consensus scope of cluster 275 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00169 Carbamoylphosphate C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine C06059 Cyclicamidines C11824 Cyclicamide Consensus scope of cluster 276 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04718 1,6,6-Trimethyl-2,7-dioxabicyclo3.2.2nonan-3-one C06066 4,5-Dihydro-5,5-dimethyl-4-3-oxobutylfuran-23H-onehexanoate Consensus scope of cluster 277 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06067 Dimethylallyltryptophan C06068 Elymoclavine Consensus scope of cluster 278 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06102 Adipatesemialdehyde C06105 Cyclohexan-1,2-dione Consensus scope of cluster 279 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00014 NH3 C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00088 Nitrite C00189 Ethanolamine C00192 Hydroxylamine C00244 Nitrate C00266 Glycolaldehyde C00282 Hydrogen C00319 Sphingosine C00346 Ethanolaminephosphate C00517 Hexadecanal C00536 Triphosphate C00697 Nitrogen C00704 O2.- C00836 Sphinganine C01120 Sphinganine1-phosphate C01548 Acetylene C01837 Nitroethane C02466 Trimetaphosphate C03167 Phosphonoacetaldehyde C03557 2-Aminoethylphosphonate C05359 e- C05360 Diimine C05361 Hydrazine C06123 Hexadecenal C06124 Sphingosine1-phosphate C06771 Triethanolamine C06772 Diethanolamine Consensus scope of cluster 280 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00207 Acetone C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C06144 3-Butynoate Consensus scope of cluster 281 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05316 Dihydromacarpine C06165 Macarpine Consensus scope of cluster 282 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06171 7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-5_-morphinan-6-one C06172 Neopinone Consensus scope of cluster 283 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00783 Tropinone C06179 Hygrine Consensus scope of cluster 284 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02718 N-Formiminoglycine C06195 Imidazolone Consensus scope of cluster 285 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02059 Phylloquinone C06245 Phylloquinol Consensus scope of cluster 286 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05194 Dihydrochelirubine C06327 Chelirubine Consensus scope of cluster 287 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06390 16-alpha-Hydroxypregnenolone C06392 16,17-Didehydropregnenolone Consensus scope of cluster 288 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06395 Protein-L-serine C06396 Protein-D-serine Consensus scope of cluster 289 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose Consensus scope of cluster 290 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06399 Hydrogenobyrinate C06408 Precorrin8X Consensus scope of cluster 291 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06231 Ectoine C06442 N-gamma-Acetyldiaminobutyrate Consensus scope of cluster 292 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06452 2-Hydroxypropylphosphonate C06454 Phosphonomycin Consensus scope of cluster 293 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06486 6R-6-L-erythro-1,2-Dihydroxypropyl-5,6,7,8-tetrahydro-4a-hydroxypterin C06487 6R-6-L-erythro-1,2-Dihydroxypropyl-7,8-dihydro-6H-pterin Consensus scope of cluster 294 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01380 Ethyleneglycol C06548 Ethyleneoxide Consensus scope of cluster 295 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03206 12-Dehydrotetracycline C06624 Oxytetracycline Consensus scope of cluster 296 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06631 dTDP-beta-L-mycarose Consensus scope of cluster 297 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01912 Erythromycin C06634 ErythromycinE Consensus scope of cluster 298 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00115 Chloride C00704 O2.- C01327 HCl C01486 Chlorite C04596 1,1-Dichloro-2,2-bis4-chlorophenylethylene C04623 1,1,1-Trichloro-2,2-bis4-chlorophenylethane C06636 1,1-Dichloro-2,2-bis4'-chlorophenylethane C06637 1-Chloro-2,2-bis4'-chlorophenylethylene C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate C06646 2-4'-Chlorophenyl-3,3-dichloropropenoate C06649 cis-2,3-Dihydrodiol1,1,1-Trichloro-2,2-bis4'-chlorophenylethane C11353 2-Hydroxy-3-chloropenta-2,4-dienoate Consensus scope of cluster 299 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06650 2,3-Dihydroxy1,1,1-Trichloro-2,2-bis4'-chlorophenylethane C06651 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8,8-tetrachloroocta-2E,4E-dienoate Consensus scope of cluster 300 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06661 Clavulanate-9-aldehyde C06662 Clavulanicacid Consensus scope of cluster 301 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07090 Protoanemonin C07091 cis-Acetylacrylate Consensus scope of cluster 302 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07113 Acetophenone C07189 2-Hydroxyacetophenone Consensus scope of cluster 303 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07299 Cutin C07300 Cutinmonomer Consensus scope of cluster 304 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone Consensus scope of cluster 305 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00281 Sedoheptulose7-phosphate C00704 O2.- C07836 D-glycero-D-manno-Heptose7-phosphate Consensus scope of cluster 306 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03103 Cyclobutadipyrimidine C08249 Pyrimidine5'-deoxynucleotide Consensus scope of cluster 307 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C08579 Antheraxanthin C08584 Capsanthin Consensus scope of cluster 308 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09024 Ajmalicine C09241 Serpentine Consensus scope of cluster 309 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00766 Flavanone C09321 2'-Hydroxychalcone Consensus scope of cluster 310 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C08578 Butein C09614 Butin Consensus scope of cluster 311 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01378 Fustin C09736 Fisetinidol-4beta-ol Consensus scope of cluster 312 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 313 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01063 6-Carboxyhexanoyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA Consensus scope of cluster 314 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00180 Benzoate C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine C09814 Benzonitrile C09815 Benzamide Consensus scope of cluster 315 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA Consensus scope of cluster 316 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01562 Calycosin C10522 Pseudobaptigenin Consensus scope of cluster 317 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06178 1-Methylpyrrolinium C10974 4-Methylaminobutanal Consensus scope of cluster 318 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09844 1,8-Cineole C11393 --alpha-Terpineol Consensus scope of cluster 319 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01767 --Carvone C11395 4R,6R-cis-Carveol Consensus scope of cluster 320 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate Consensus scope of cluster 321 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11417 3S-6-Hydroxy-3-isopropenyl-heptanoate C11419 3S-3-Isopropenyl-6-oxoheptanoate Consensus scope of cluster 322 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol Consensus scope of cluster 323 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C06331 2-Methylquinoline-3,4-diol C06332 N-Acetylanthranilate C11504 3-Hydroxy-2-methyl-1H-quinolin-4-one Consensus scope of cluster 324 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00058 Formate C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00414 Cyclohexanone C00488 Formamide C00571 Cyclohexylamine C00697 Nitrogen C00704 O2.- C01326 Hydrogencyanide C05359 e- C05360 Diimine C05361 Hydrazine C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide Consensus scope of cluster 325 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00080 H+ C00536 Triphosphate C00704 O2.- C01204 myo-Inositolhexakisphosphate C02466 Trimetaphosphate C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04579 Inositol1,2,3,4,5-pentakisphosphate C11526 5-PP-InsP5 C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate Consensus scope of cluster 326 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05773 Cobyrinate C11545 Cobalt-precorrin8 Consensus scope of cluster 327 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00067 Formaldehyde C00080 H+ C00132 Methanol C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C02151 Geissoschizine C03459 2-Hydroxy-3-oxosuccinate C11632 Polyneuridinealdehyde C11633 16-Epivellosimine C11634 Vellosimine Consensus scope of cluster 328 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11633 16-Epivellosimine C11634 Vellosimine Consensus scope of cluster 329 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01626 Vindoline C03309 Strictosidineaglycone C03677 4,21-Dehydrogeissoschizine C07201 Vinblastine C09107 Catharanthine C09244 Tabersonine C11641 3',4'-Anhydrovinblastine C11678 Dialdehyde C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Consensus scope of cluster 330 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01512 Loganate C11672 10-Deoxygeniposidicacid Consensus scope of cluster 331 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04578 16-Methoxy-2,3-dihydro-3-hydroxytabersonine C11675 16-Methoxytabersonine Consensus scope of cluster 332 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09337 Ankorine C11816 Protoemetine Consensus scope of cluster 333 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01389 Phytol C02139 Chlorophyllide C05306 Chlorophylla C11850 Divinylchlorophylla Consensus scope of cluster 334 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06096 GibberellinA29 C11855 GibberellinA29-catabolite Consensus scope of cluster 335 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11859 GibberellinA37openlactone C11862 GibberellinA36 Consensus scope of cluster 336 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11854 GibberellinA51-catabolite C11865 GibberellinA51 Consensus scope of cluster 337 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11863 GibberellinA9 C11866 2,3-Dehydro-gibberellinA9 Consensus scope of cluster 338 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11864 GibberellinA4 C11867 GibberellinA7 Consensus scope of cluster 339 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11868 GibberellinA34 C11869 GibberellinA34-catabolite Consensus scope of cluster 340 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C03579 2beta-Hydroxygibberellin1 C11870 GibberellinA8-catabolite Consensus scope of cluster 341 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02035 GibberellinA20 C11871 GibberellinA5 Consensus scope of cluster 342 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11884 Neoabietinol C11885 Neoabietal Consensus scope of cluster 343 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11883 Levopimarinol C11886 Levopimarinal Consensus scope of cluster 344 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11882 Abietinol C11887 Abietal Consensus scope of cluster 345 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose Consensus scope of cluster 346 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose Consensus scope of cluster 347 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11929 Perillyl-CoA C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA Consensus scope of cluster 348 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11935 4-Isopropenyl-2-oxy-cyclohexanecarboxyl-CoA C11936 3-Isopropenylpimelyl-CoA Consensus scope of cluster 349 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06428 5Z,8Z,11Z,14Z,17Z-Icosapentaenoicacid C12083 5Z,7E,9E,14Z,17Z-Eicosapentaenoicacid Consensus scope of cluster 350 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12213 Kanosamine6-phosphate C12214 Aminofructose6-phosphate Consensus scope of cluster 351 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12366 TetracenomycinF2 C12367 TetracenomycinF1 Consensus scope of cluster 352 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12396 Tetrangomycin C12397 Tetrangulol Consensus scope of cluster 353 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12410 UrdamycinoneF C12412 Aquayamycin Consensus scope of cluster 354 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12431 13-Dihydrocarminomycin C12432 Carminomycin Consensus scope of cluster 355 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12434 S-DNPA C12435 5-Deoxodihydrokalafungin Consensus scope of cluster 356 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12436 Dihydrokalafungin C12437 Medermycin Consensus scope of cluster 357 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C10858 Ecgonine C12449 Pseudoecgonine Consensus scope of cluster 358 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06181 Piperideine C12455 5-Aminopentanal Consensus scope of cluster 359 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C12456 3-Dimethylallyl-4-hydroxyphenylpyruvate C12457 3-Dimethylallyl-4-hydroxymandelicacid C12458 3-Dimethylallyl-4-hydroxybenzoate Consensus scope of cluster 360 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01327 HCl C12831 3,4,6-Trichlorocatechol C12833 2,3,5-Trichloro-cis,cis-muconate C12834 2,5-Dichloro-carboxymethylenebut-2-en-4-olide C12835 2,5-Dichloro-4-oxohex-2-enedioate Consensus scope of cluster 361 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12834 2,5-Dichloro-carboxymethylenebut-2-en-4-olide C12835 2,5-Dichloro-4-oxohex-2-enedioate Consensus scope of cluster 362 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C13626 5-HydroxybisphenolA C13628 4,5-Bisphenol-o-quinone Consensus scope of cluster 363 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00633 4-Hydroxybenzaldehyde C00704 O2.- C10700 4'-Hydroxyacetophenone C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene Consensus scope of cluster 364 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13633 2,2-Bis4-hydroxyphenyl-propanoicacid Consensus scope of cluster 365 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00805 Salicylate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid Consensus scope of cluster 366 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA Consensus scope of cluster 367 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06006 S-2-Aceto-2-hydroxybutanoate C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate Consensus scope of cluster 368 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12044 Rifamycin C14540 RifamycinS Consensus scope of cluster 369 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14602 3-Hydroxyaminophenol C14604 Aminohydroquinone Consensus scope of cluster 370 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12247 RifamycinW C14723 RifamycinZ Consensus scope of cluster 371 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14768 5,6-EET C14772 5,6-DHET Consensus scope of cluster 372 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14769 8,9-EET C14773 8,9-DHET Consensus scope of cluster 373 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14770 11,12-EET C14774 11,12-DHET Consensus scope of cluster 374 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14771 14,15-EET C14775 14,15-DHET Consensus scope of cluster 375 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02617 1,4-Naphthoquinone C14785 1,4-Dihydroxynaphthalene Consensus scope of cluster 376 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14788 1-Nitrosonaphthalene C14789 N-Hydroxy-1-aminonaphthalene Consensus scope of cluster 377 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14800 1-Nitronaphthalene-5,6-oxide C14801 1-Nitro-5,6-dihydroxy-dihydronaphthalene Consensus scope of cluster 378 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14818 Fe2+ C14819 Fe3+ Consensus scope of cluster 379 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14825 910-EpOME C14828 9,10-DHOME Consensus scope of cluster 380 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14826 1213-EpOME C14829 12,13-DHOME Consensus scope of cluster 381 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14556 9-Hydroxybenzoapyrene C14849 Benzoapyrene-9,10-oxide Consensus scope of cluster 382 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14850 Benzoapyrene-7,8-oxide C14852 Benzoapyrene-7,8-diol Consensus scope of cluster 383 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14858 2,2-Dichloroacetaldehyde C14860 2,2-Dichloro-1,1-ethanediol Consensus scope of cluster 384 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06899 Chloralhydrate C14866 Chloral Consensus scope of cluster 385 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11148 TCEepoxide C14867 Dichloroacetylchloride Consensus scope of cluster 386 C00001 H2O C00007 Oxygen C00010 CoA C00027 H2O2 C00080 H+ C00704 O2.- C03160 2-Succinylbenzoyl-CoA C03657 1,4-Dihydroxy-2-naphthoate C06986 Spirodilactone C15547 1,4-Dihydroxy-2-naphthoyl-CoA Consensus scope of cluster 387 C00001 H2O C00007 Oxygen C00010 CoA C00027 H2O2 C00080 H+ C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C00704 O2.- C01794 Choloyl-CoA C04483 3alpha,12alpha-Dihydroxy-5beta-cholanate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate C15560 Deoxycholoyl-CoA Consensus scope of cluster 388 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15568 7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate C15569 12alpha-Hydroxy-3-oxochola-4,6-dienoate Consensus scope of cluster 389 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00525 D-Tryptophan C00704 O2.- C15605 N-Formyl-D-kynurenine Consensus scope of cluster 390 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03373 Aminoimidazoleribotide C03459 2-Hydroxy-3-oxosuccinate C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole Consensus scope of cluster 391 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00555 4-Aminobutanal C00704 O2.- C15668 1-Pyrroline Consensus scope of cluster 392 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11522 24-Methylenelophenol C15776 4alpha-Methylfecosterol Consensus scope of cluster 393 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01789 Campesterol C15784 Campest-4-en-3beta-ol Consensus scope of cluster 394 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15786 5alpha-Campestan-3-one C15787 Campestanol Consensus scope of cluster 395 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15788 6alpha-Hydroxycampestanol C15789 6-Oxocampestanol Consensus scope of cluster 396 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15795 22alpha-Hydroxy-campesterol C15796 22alpha-Hydroxy-campest-4-en-3-one Consensus scope of cluster 397 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02646 4-Coumarylalcohol C15804 p-Hydroxyphenyllignin Consensus scope of cluster 398 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00590 Coniferylalcohol C00704 O2.- C15805 Guaiacyllignin Consensus scope of cluster 399 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02325 Sinapylalcohol C15806 Syringyllignin Consensus scope of cluster 400 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C12205 5-Hydroxyconiferylalcohol C15807 5-Hydroxy-guaiacyllignin Consensus scope of cluster 401 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15812 C15812 C15813 C15813 C15814 C15814 C15815 C15815 Consensus scope of cluster 402 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- C15877 Anhydrorhodovibrin C15878 Rhodovibrin C15879 Hydroxyspirilloxanthin Consensus scope of cluster 403 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14151 delta-Tocopherol C15882 2-Methyl-6-phytylquinol Consensus scope of cluster 404 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C02483 gamma-Tocopherol C15883 2,3-Dimethyl-5-phytylquinol Consensus scope of cluster 405 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin Consensus scope of cluster 406 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15928 4-Ketomyxol C15932 4-Hydroxymyxol Consensus scope of cluster 407 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16001 Reactiveblack5 C16002 Oxidizedreactiveblack5 Consensus scope of cluster 408 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16014 cis-Stilbeneoxide C16015 +-1R,2R-1,2-Diphenylethane-1,2-diol Consensus scope of cluster 409 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16144 Dehydrosqualene C16145 4,4'-Diaponeurosporene Consensus scope of cluster 410 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16188 7-Hydroxy-2',4',5'-trimethoxyisoflavone C16189 9-Demethylmunduserone Consensus scope of cluster 411 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C00858 Formononetin C16190 2,7-Dihydroxy-4'-methoxyisoflavanone Consensus scope of cluster 412 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C11481 HSO3- C16193 1,6-Naphthalenedisulfonicacid C16194 2,6-Naphthalenedisulfonicacid C16196 1,2-Dihydroxynaphthalene-6-sulfonate C16198 Z-4-2-Hydroxy-5-sulfonatophenyl-2-oxo-3-butenoate Consensus scope of cluster 413 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16196 1,2-Dihydroxynaphthalene-6-sulfonate C16198 Z-4-2-Hydroxy-5-sulfonatophenyl-2-oxo-3-butenoate Consensus scope of cluster 414 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16212 3-Hydroxy-2-naphthoate C16214 3-6-Carboxymethylenecyclohexa-2,4-dien-1-ylidene-2-oxopropanate Consensus scope of cluster 415 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA Consensus scope of cluster 416 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C14314 4',6,7-Trihydroxyisoflavone C16233 2,6,7,4'-Tetrahydroxyisoflavanone Consensus scope of cluster 417 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C03925 3,5-Dibromo-4-hydroxybenzoate C04178 3,5-Dibromo-4-hydroxybenzonitrile C05359 e- C05360 Diimine C05361 Hydrazine C16246 3,5-Dibromo-4-hydroxybenzamide Consensus scope of cluster 418 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06719 Dihydrophloroglucinol C16272 3-Hydroxy-5-oxohexanoate Consensus scope of cluster 419 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05434 beta-Zeacarotene C16291 7,8-Dihydro-beta-carotene Consensus scope of cluster 420 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16309 Traumatin C16311 12-Oxo-9Z-dodecenoicacid Consensus scope of cluster 421 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16328 trans-2-Enoyl-OPC8-CoA C16329 3-Hydroxy-OPC8-CoA Consensus scope of cluster 422 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16332 trans-2-Enoyl-OPC6-CoA C16333 3-Hydroxy-OPC6-CoA Consensus scope of cluster 423 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16336 trans-2-Enoyl-OPC4-CoA C16337 3-Hydroxy-OPC4-CoA Consensus scope of cluster 424 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16353 7-Methylxanthine C16355 7-Methyluricacid Consensus scope of cluster 425 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C13747 1,7-Dimethylxanthine C16356 1,7-Dimethyluricacid Consensus scope of cluster 426 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16358 1-Methylxanthine C16359 1-Methyluricacid Consensus scope of cluster 427 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C07480 Theobromine C16360 3,7-Dimethyluricacid Consensus scope of cluster 428 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16374 2E,6Z,9Z,12Z,15Z,18Z,21Z-Tetracosahepta-2,6,9,12,15,18,21-enoyl-CoA C16375 6Z,9Z,12Z,15Z,18Z,21Z-3-Hydroxytetracosahexa-6,9,12,15,18,21-enoyl-CoA Consensus scope of cluster 429 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16387 2E,6Z,9Z,12Z,15Z,18Z-Tetracosahexa-2,6,9,12,15,18-enoyl-CoA C16388 6Z,9Z,12Z,15Z,18Z-3-Hydroxytetracosapenta-6,9,12,15,18-enoyl-CoA Consensus scope of cluster 430 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09827 Pinocembrin C16404 Pinocembrinchalcone Consensus scope of cluster 431 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09756 Homoeriodictyol C16405 Homoeriodictyolchalcone Consensus scope of cluster 432 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16402 2,4-Dihydroxylamino-6-nitrotoluene C16414 2-Amino-5-hydroxyl-4-hydroxylamino-6-nitrotoluene Consensus scope of cluster 433 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09751 Garbanzol C16415 5-Deoxyleucopelargonidin Consensus scope of cluster 434 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C09789 Naringin C16423 Naringinchalcone datasetS2/semiStrict/hierarchical_clusters.txt0000644000175000017500000021444610747436025021546 0ustar oliveroliverMetabolites in cluster 1: C00021 S-Adenosyl-L-homocysteine C00025 L-Glutamate C00037 Glycine C00041 L-Alanine C00047 L-Lysine C00049 L-Aspartate C00051 Glutathione C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00073 L-Methionine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00082 L-Tyrosine C00086 Urea C00097 L-Cysteine C00106 Uracil C00108 Anthranilate C00113 PQQ C00127 Glutathionedisulfide C00133 D-Alanine C00135 L-Histidine C00147 Adenine C00152 L-Asparagine C00155 L-Homocysteine C00179 Agmatine C00188 L-Threonine C00212 Adenosine C00213 Sarcosine C00217 D-Glutamate C00242 Guanine C00262 Hypoxanthine C00270 N-Acetylneuraminate C00292 Aniline C00294 Inosine C00295 Orotate C00299 Uridine C00300 Creatine C00327 L-Citrulline C00328 L-Kynurenine C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00398 Tryptamine C00402 D-Aspartate C00407 L-Isoleucine C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00463 Indole C00475 Cytidine C00491 L-Cystine C00499 Allantoate C00506 L-Cysteate C00515 D-Ornithine C00542 Cystathionine C00568 4-Aminobenzoate C00581 Guanidinoacetate C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00632 3-Hydroxyanthranilate C00643 5-Hydroxy-L-tryptophan C00666 LL-2,6-Diaminoheptanedioate C00669 gamma-L-Glutamyl-L-cysteine C00680 meso-2,6-Diaminoheptanedioate C00716 Serine C00739 D-Lysine C00740 D-Serine C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00813 Barbiturate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00855 D-Methionine C00884 Homocarnosine C00906 5,6-Dihydrothymine C00916 CephalosporinC C00921 Dihydropteroate C00931 Porphobilinogen C00940 2-Oxoglutaramate C00977 L-Tryptophanamide C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01047 N5-Ethyl-L-glutamine C01059 2,5-Dihydroxypyridine C01060 3,5-Diiodo-L-tyrosine C01118 O-Succinyl-L-homoserine C01142 3S-3,6-Diaminohexanoate C01157 trans-4-Hydroxy-L-proline C01162 3-Pyrazol-1-yl-L-alanine C01186 3S,5S-3,5-Diaminohexanoate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01259 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine C01417 Cyanate C01419 Cys-Gly C01537 Urethane C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01586 Hippurate C01596 Maleamate C01667 Bacitracin C01762 Xanthosine C01921 Glycocholate C01993 5'-Oxoinosine C02091 Ureidoglycine C02166 LeukotrieneC4 C02218 2-Aminoacrylate C02220 2-Aminomuconate C02237 5-Oxo-D-proline C02253 Benzoylagmatine C02291 L-Cystathionine C02294 Methylguanidine C02348 R--Allantoin C02350 S+-Allantoin C02362 2-Oxosuccinamate C02512 3-Cyano-L-alanine C02564 N-Feruloylglycine C02634 3-Chloro-D-alanine C02635 3-Chloro-L-alanine C02642 3-Ureidopropionate C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02775 2,3-Dihydroxyindole C02837 L-Lysine1,6-lactam C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02999 N-Acetylmuramoyl-Ala C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03065 3-Guanidinopropanoate C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03139 N-Amidino-L-aspartate C03145 N-Formyl-L-methionine C03174 S-Succinylglutathione C03227 3-Hydroxy-L-kynurenine C03283 L-2,4-Diaminobutanoate C03290 L-threo-3-Phenylserine C03296 N2-Succinyl-L-arginine C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03451 R-S-Lactoylglutathione C03458 2,3,6-Trihydroxypyridine C03470 3-alphaS-Strictosidine C03508 L-2-Amino-3-oxobutanoicacid C03539 S-Ribosyl-L-homocysteine C03574 2-Formylaminobenzaldehyde C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03626 NG,NG-Dimethyl-L-arginine C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03710 N-Benzyloxycarbonylglycine C03722 Pyridine-2,3-dicarboxylate C03741 S-4-Amino-5-oxopentanoate C03771 5-Guanidino-2-oxopentanoate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C04075 L-2-Amino-4-chloropent-4-enoate C04079 N-R-Pantothenoyl-L-cysteine C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04409 2-Amino-3-carboxymuconatesemialdehyde C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04690 2-Hydroxymethyl-3-acetamidomethylenesuccinate C04771 S-2-Amino-3-3-hydroxy-4-oxo-4H-pyridin-1-ylpropanoate C04776 D-Galactosyl-3-N-acetyl-beta-D-galactosaminyl-L-serine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C05100 3-Ureidoisobutyrate C05133 4-Imidazolone-5-acetate C05161 2,5-Diaminohexanoate C05281 5-Methylbarbiturate C05328 D-2-Amino-hexano-6-lactam C05335 Selenomethionine C05341 beta-Alanyl-L-lysine C05380 Nicotinurate C05464 Glycodeoxycholate C05466 Glycochenodeoxycholate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05524 Aminoacyl-L-methionine C05552 N6-D-Biotinyl-L-lysine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05575 Hercynine C05640 Cinnavalininate C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05658 Indoxyl C05692 Se-Adenosylselenohomocysteine C05699 Selenocystathionine C05711 gamma-Glutamyl-beta-cyanoalanine C05730 Glutathionylspermidine C05829 N-Carbamyl-L-glutamate C05831 3-Methoxyanthranilate C05840 Iminoaspartate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05951 LeukotrieneD4 C06034 4-Hydroxy-4-methylglutamate C06073 Indolealkaloid C06234 4-Methyl-L-glutamate C06330 Quinoline-3,4-diol C06381 Methylenediurea C06382 N-Carboxyaminomethylurea C06393 2,3-Diaminopropanoate C06462 LeukotrieneF4 C06551 Atrazine C06552 Hydroxyatrazine C06553 N-Isopropylammelide C06554 Cyanuricacid C06555 Biuret C06556 Deisopropylatrazine C06557 Deisopropylhydroxyatrazine C06558 2,4-Dihydroxy-6-N'-ethylamino-1,3,5-triazine C06559 Deethylatrazine C06560 Deisopropyldeethylatrazine C06657 Guanidinoproclavaminicacid C06673 4-Carboxy-4'-sulfoazobenzene C06732 alpha,beta-Didehydrotryptophan C06751 Prenyl-L-cysteine C06813 Nitrobenzene C07272 Maleimide C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08735 2-Chloro-4-hydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11631 9-Riburonosylhypoxanthine C11817 Deoxytubulosine C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12989 N2-Acetyl-L-lysine C14147 Cyromazine C14148 N-Cyclopropylammeline C14149 N-Cyclopropylammelide C14180 S-Hydroxymethylglutathione C14419 2,4-Dichloroaniline C14450 4-Chloroaniline C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14803 1-Nitro-7-hydroxy-8-glutathionyl-7,8-dihydronaphthalene C14804 1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene C14805 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene C14806 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalene C14847 3,4-Dihydro-3-hydroxy-4-S-glutathionylbromobenzene C14848 2,3-Dihydro-2-S-glutathionyl-3-hydroxybromobenzene C14855 4,5-Dihydro-4-hydroxy-5-S-glutathionyl-benzoapyrene C14856 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzoapyrene C14861 S-2,2-Dichloro-1-hydroxyethylglutathione C14863 2-S-Glutathionylacetylglutathione C15523 2,6-Dihydroxynicotinate C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15607 3-Oxo-3-ureidopropanoate C15767 gamma-Glutamyl-gamma-aminobutyraye C15809 Iminoglycine C16235 o-Hydroxylaminobenzoate Metabolites in cluster 2: C00022 Pyruvate C00036 Oxaloacetate C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00166 Phenylpyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00251 Chorismate C00254 Prephenate C00256 R-Lactate C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00497 R-Malate C00502 D-Xylonate C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00804 Propynoate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01187 3-Deoxy-D-manno-octulosonate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01384 Maleicacid C01424 Gallate C01572 Digallate C01680 D-Fuconate C01732 Mesaconate C01934 L-Rhamnonate C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02295 Methylitaconate C02341 trans-Aconitate C02351 1,2-Benzoquinone C02375 4-Chlorocatechol C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02914 S-2-O-Sulfolactate C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C02991 L-Rhamnono-1,4-lactone C03012 Naphthalene-1,2-diol C03063 2-Oxohept-3-enedioate C03164 Phenanthrene-3,4-diol C03203 1-Hydroxy-2-naphthoate C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03340 L-2,3-Dihydrodipicolinate C03453 Z-5-Oxohex-2-enedioate C03548 trans-2,3-Epoxysuccinate C03569 2,2',3-Trihydroxybiphenyl C03572 2-Chloro-cis,cis-muconate C03585 3-Chloro-cis,cis-muconate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04522 2-Chloro-2,5-dihydro-5-oxofuran-2-acetate C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05527 3-Sulfinylpyruvate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05618 3-Chlorocatechol C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06159 2-Dehydro-3-deoxy-D-fuconate C06201 2,4-Dihydroxyhept-2-enedioate C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06336 3-Sulfocatechol C06580 2,3-Dihydroxy-p-cumate C06581 2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate C06582 2-Hydroxy-6-oxo-7-methylocta-2,4-dienoate C06586 2,3-Dihydroxy-4'-chlorobiphenyl C06587 2-Hydroxy-6-oxo-6-4'-chlorophenyl-hexa-2,4-dienoate C06609 trans-1,3-Dichloropropene C06610 cis-1,3-Dichloropropene C06611 trans-3-Chloro-2-propene-1-ol C06612 cis-3-Chloro-2-propene-1-ol C06613 3-Chloroallylaldehyde C06614 trans-3-Chloroacrylicacid C06615 cis-3-Chloroacrylicacid C06711 Fluoren-9-ol C06712 Fluoren-9-one C06728 3-Ethylcatechol C06730 4-Methylcatechol C06744 3-Deoxyoctulosonyl-lipopolysaccharide C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07089 5-Chloro-2-hydroxymuconicsemialdehyde C07102 5-Chloro-1,2,4-trihydroxybenzene C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07715 Fluorene C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C09816 Benzylsuccinate C11354 2-Hydroxy-cis-hex-2,4-dienoate C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12836 2-Chloro-3-oxoadipate C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14105 1,2-Dihydroxy-7-hydroxymethylnaphthalene C14106 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate C14107 2-Hydroxy-4-hydroxymethylbenzalpyruvate C14115 Naphthyl-2-methyl-succinicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14783 1,2-Naphthoquinone C16069 3-Sulfolactate C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16199 5-Sulfosalicylate C16201 1-Naphthalenesulfonicacid C16202 2-Naphthalenesulfonicacid C16204 1,2-Anthracenediol C16209 3-2-Carboxyvinylnaphthalene-2-carboxylicacid C16210 4-3-Hydroxy-2-naphthyl-2-oxobut-3-enoicacid C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16266 3-Chloro-2-hydroxymuconicsemialdehyde C16348 cis-3-Chloroallylaldehyde C16390 S-2-Hydroxymethylglutarate Metabolites in cluster 3: C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00008 ADP C00015 UDP C00016 FAD C00020 AMP C00029 UDP-glucose C00035 GDP C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00063 CTP C00075 UTP C00081 ITP C00096 GDP-mannose C00104 IDP C00105 UMP C00112 CDP C00128 CMP-N-acetylneuraminate C00130 IMP C00144 GMP C00167 UDP-glucuronate C00190 UDP-D-xylose C00203 UDP-N-acetyl-D-galactosamine C00239 dCMP C00286 dGTP C00301 ADP-ribose C00360 dAMP C00362 dGMP C00365 dUMP C00394 GDP-glucose C00458 dCTP C00460 dUTP C00498 ADP-glucose C00513 CDP-glycerol C00575 3',5'-CyclicAMP C00617 UDP-D-galacturonate C00655 Xanthosine5'-phosphate C00700 XTP C00705 dCDP C00857 Deamino-NAD+ C00935 UDP-L-arabinose C00942 3',5'-CyclicGMP C01005 O-Phospho-L-serine C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01201 Nomega-ADP-D-ribosyl-L-arginine C01222 GDP-4-dehydro-6-deoxy-D-mannose C01228 Guanosine3',5'-bisdiphosphate C01233 sn-glycero-3-Phosphoethanolamine C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01299 Adenylyl-L-glutamate:ammonialigaseADP-forming C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01367 3'-AMP C01368 3'-UMP C02280 GDP-L-galactose C02305 Phosphocreatine C02330 UDP-L-iduronate C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02532 D-O-Phosphoserine C02739 Phosphoribosyl-ATP C03483 Adenosinetetraphosphate C03506 Indoleglycerolphosphate C03614 Inosine5'-tetraphosphate C03691 CMP-N-glycoloylneuraminate C03733 UDP-alpha-D-galacto-1,4-furanose C03794 N6-1,2-Dicarboxyethyl-AMP C03872 L-Serine-phosphoethanolamine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04494 Guanosine3'-diphosphate5'-triphosphate C04652 UDP-2,3-bis3-hydroxytetradecanoylglucosamine C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C05005 Glycolipid C05114 Mucopolysaccharide C05227 UDP-sugar C05672 2-Amino-3-phosphonopropanoate C05822 3'-CMP C05922 Formamidopyrimidinenucleosidetriphosphate C05993 Acetyladenylate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06241 N-Acetylneuraminate9-phosphate C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C14830 GDP-4-keto-6-L-deoxygalactose C15925 GDP-L-gulose Metabolites in cluster 4: C00085 D-Fructose6-phosphate C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00199 D-Ribulose5-phosphate C00231 D-Xylulose5-phosphate C00275 D-Mannose6-phosphate C00354 D-Fructose1,6-bisphosphate C00447 D-Sedoheptulose1,7-bisphosphate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00670 sn-glycero-3-Phosphocholine C00689 alpha,alpha'-Trehalose6-phosphate C01094 D-Fructose1-phosphate C01099 L-Fuculose1-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01131 L-Rhamnulose1-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01185 NicotinateD-ribonucleotide C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C02591 Sucrose6-phosphate C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03394 Erythrulose1-phosphate C03536 Pyrimidine5'-nucleotide C03546 myo-Inositol4-phosphate C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04645 6-D-Glucose-1-phospho-D-mannosylglycoprotein C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05396 Lactose6-phosphate C06019 D-arabino-3-Hexulose6-phosphate C06187 Arbutin6-phosphate C06188 Salicin6-phosphate C06441 L-Xylulose1-phosphate C15585 myo-Inositolphosphate Metabolites in cluster 5: C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00392 Mannitol C00464 Mannan C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00761 Coniferin C00817 D-Altronate C00844 R-Prunasin C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01158 1-O-Galloyl-beta-D-glucose C01533 Syringin C01742 Palatinose C01982 R-Amygdalin C02013 Cellotetraose C02074 Raucaffricine C02655 6-Acetyl-D-glucose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03855 Cholesteryl-beta-D-glucoside C03915 1-O-Sinapoylbeta-D-glucoside C04218 alpha,alpha'-Trehalose6-mycolate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05403 3-Ketolactose C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C06046 Salidroside C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Metabolites in cluster 6: C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Metabolites in cluster 7: C00074 Phosphoenolpyruvate C00197 3-Phospho-D-glycerate C00236 3-Phospho-D-glyceroylphosphate C00345 6-Phospho-D-gluconate C00363 dTDP C00364 dTMP C00459 dTTP C00631 2-Phospho-D-glycerate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C01159 2,3-Bisphospho-D-glycerate C01182 D-Ribulose1,5-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C02798 3-Phosphonopyruvate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C11536 2R-O-Phospho-3-sulfolactate C12106 AminoDAHP C14899 3-Dehydro-L-gulonate6-phosphate C16186 L-Ascorbate6-phosphate Metabolites in cluster 8: C00011 CO2 C00048 Glyoxylate C00160 Glycolate C00168 Hydroxypyruvate C00183 L-Valine C00209 Oxalate C00237 CO C00249 Hexadecanoicacid C00389 Quercetin C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01812 Haloacetate C01838 Octadecanal C02080 Stipitatonate C02367 3-Oxododecanoicacid C02657 6-Methylsalicylate C03066 3-Hydroxy-L-glutamate C03459 2-Hydroxy-3-oxosuccinate C04236 2S-2-Isopropyl-3-oxosuccinate C04352 R-4'-Phosphopantothenoyl-L-cysteine C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate Metabolites in cluster 9: C00024 Acetyl-CoA C00083 Malonyl-CoA C00091 Succinyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00406 Feruloyl-CoA C00531 Itaconyl-CoA C00566 3S-Citryl-CoA C00683 S-2-Methyl-3-oxopropanoyl-CoA C00904 Citramalyl-CoA C01011 3S-Citramalyl-CoA C01213 R-2-Methyl-3-oxopropanoyl-CoA C02557 Methylmalonyl-CoA C03231 3-Methylglutaconyl-CoA C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA Metabolites in cluster 10: C05421 15-cis-Phytoene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15870 Rhodopin C15892 Chloroxanthin C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16276 epsilon-Carotene Metabolites in cluster 11: C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose Metabolites in cluster 12: C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C03190 +-Bornyl-diphosphate C03427 Prephytoenediphosphate C06076 Comphene C06089 ent-Copalyldiphosphate C06111 Nerolidyldiphosphate C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate Metabolites in cluster 13: C15791 Teasterone C15792 3-Dehydroteasterone C15793 Typhasterol C15794 Castasterone C15797 22alpha-Hydroxy-5alpha-campestan-3-one C15798 6-Deoxocathasterone C15799 6-Deoxoteasterone C15800 3-Dehydro-6-deoxoteasterone C15801 6-Deoxotyphasterol C15802 6-Deoxocastasterone C15803 6alpha-Hydroxy-castasterone Metabolites in cluster 14: C03309 Strictosidineaglycone C03677 4,21-Dehydrogeissoschizine C09107 Catharanthine C09244 Tabersonine C11678 Dialdehyde C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Metabolites in cluster 15: C00472 p-Benzoquinone C00530 p-Benzenediol C02222 2-Maleylacetate C02814 Benzene-1,2,4-triol C03676 3-Hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate Metabolites in cluster 16: C00072 Ascorbate C00425 Dehydroascorbate C00800 L-Gulonate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01115 L-Galactono-1,4-lactone C03289 L-xylo-Hexulonolactone C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05422 L-Dehydroascorbate C15930 L-Galactonate Metabolites in cluster 17: C01226 12-OPDA C04594 9Z-13S-12,13-Epoxyoctadeca-9,11-dienoicacid C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C06427 9Z,12Z,15Z-Octadecatrienoicacid C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16324 9,10-EOT C16325 10-OPDA Metabolites in cluster 18: C01054 S-2,3-Epoxysqualene C01724 Lanosterol C01902 Cycloartenol C06085 Triterpenoid C08615 alpha-Amyrin C08616 beta-Amyrin C08628 Lupeol C08980 SoyasapogenolB C08983 SoyasaponinI Metabolites in cluster 19: C00053 3'-Phosphoadenylylsulfate C00068 Thiamindiphosphate C00224 Adenylylsulfate C00882 Dephospho-CoA C01081 Thiaminmonophosphate C03028 Thiamintriphosphate C04327 4-Methyl-5-2-phosphoethyl-thiazole C05125 2-alpha-Hydroxyethylthiaminediphosphate C11521 UDP-6-sulfoquinovose Metabolites in cluster 20: C00136 Butanoyl-CoA C00630 2-Methylpropanoyl-CoA C02939 3-Methylbutanoyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03460 2-Methylprop-2-enoyl-CoA C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C05996 Branchedchainfattyacid C06000 S-3-Hydroxyisobutyryl-CoA C15980 S-2-Methylbutanoyl-CoA Metabolites in cluster 21: C00140 N-Acetyl-D-glucosamine C00329 D-Glucosamine C00645 N-Acetyl-D-mannosamine C01133 N-Acetyl-D-glucosaminate C01674 Chitobiose C03752 2-Amino-2-deoxy-D-gluconate C04755 GlycoproteinN-acetyl-D-glucosaminyl-phospho-D-mannose C05383 Aminosugars Metabolites in cluster 22: C00014 NH3 C00088 Nitrite C00153 Nicotinamide C00192 Hydroxylamine C00244 Nitrate C00388 1H-Imidazole-4-ethanamine C05360 Diimine C05361 Hydrazine Metabolites in cluster 23: C11383 +-S-Carvone C11408 4S,6S-cis-Carveol C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol Metabolites in cluster 24: C00509 Naringenin C05631 Eriodictyol C06561 Isosalipurpol C06563 Genistein C08576 Aureusidin C08577 Bracteatin C12631 2-Hydroxy-2,3-dihydrogenistein C15525 Eriodictyolchalcone Metabolites in cluster 25: C00376 Retinal C00777 Retinoate C02094 beta-Carotene C02110 11-cis-Retinal C05918 all-trans-Dehydroretinal C05919 11-cis-Dehydroretinal C15943 Isorenieratene C16340 beta-Isorenieratene Metabolites in cluster 26: C01595 Linoleate C04056 9-cis,11-trans-Octadecadienoate C04717 9Z,11E-13S-13-Hydroperoxyoctadeca-9,11-dienoicacid C07338 9Z,12Z-11S-11-Hydroperoxyoctadeca-9,12-dienoicacid C07354 7S,8S-DiHODE C14827 9S-HPODE C14831 8R-HPODE Metabolites in cluster 27: C01693 L-Dopachrome C04185 5,6-Dihydroxyindole-2-carboxylate C05578 5,6-Dihydroxyindole C05579 Indole-5,6-quinone C05604 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole C05606 Melanin C15566 D-Dopachrome Metabolites in cluster 28: C00877 Crotonoyl-CoA C01144 S-3-Hydroxybutanoyl-CoA C02331 Vinylacetyl-CoA C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Metabolites in cluster 29: C00243 Lactose C00492 Raffinose C01613 Stachyose C05400 Epimelibiose C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose Metabolites in cluster 30: C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen C05793 L-Urobilin C05794 I-Urobilin C05795 D-Urobilin Metabolites in cluster 31: C00250 Pyridoxal C00314 Pyridoxine C00847 4-Pyridoxate C00971 4-Pyridoxolactone C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal Metabolites in cluster 32: C00352 D-Glucosamine6-phosphate C00357 N-Acetyl-D-glucosamine6-phosphate C00455 NicotinamideD-ribonucleotide C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C06156 alpha-D-Glucosamine1-phosphate Metabolites in cluster 33: C02933 3,5-Dichlorocatechol C03918 2,4-Dichloro-cis,cis-muconate C04625 2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate C07094 3,6-Dichlorocatechol C07095 2,5-Dichloro-cis,cis-muconate C07097 2,6-Dichlorohydroquinone Metabolites in cluster 34: C11396 1R,2R,4R-Dihydrocarveol C11397 1R,2S,4R-Neo-dihydrocarveol C11398 1R,4R-Dihydrocarvone C11399 1S,2S,4R-Iso-dihydrocarveol C11400 1S,2R,4R-Neoiso-dihydrocarveol C11401 1S,4R-Iso-dihydrocarvone Metabolites in cluster 35: C14453 4-Bromophenol C14839 Bromobenzene-3,4-oxide C14843 4-Bromocatechol C14844 Bromobenzene-3,4-dihydrodiol C14845 4-Bromophenol-2,3-epoxide C14846 4-Bromo-3,5-cyclohexadiene-1,2-dione Metabolites in cluster 36: C08650 Isoliquiritigenin C09762 Liquiritigenin C10200 Anhydroglycinol C10208 Daidzein C12123 7,4'-Dihydroxyflavone C15567 2,7,4'-Trihydroxyisoflavanone Metabolites in cluster 37: C00059 Sulfate C00087 Sulfur C00094 Sulfite C00320 Thiosulfate C01861 Trithionate Metabolites in cluster 38: C00124 D-Galactose C00880 D-Galactonate C01216 2-Dehydro-3-deoxy-D-galactonate C03269 D-galacto-Hexodialdose C03383 D-Galactono-1,4-lactone Metabolites in cluster 39: C00137 myo-Inositol C00191 D-Glucuronate C00905 D-Fructuronate C02670 D-Glucuronolactone C03387 D-Glucurono-6,2-lactone Metabolites in cluster 40: C00751 Squalene C06083 Tetrahymanol C06084 Hopanoid C06309 Diplopterol C06310 Diploptene Metabolites in cluster 41: C00189 Ethanolamine C01837 Nitroethane C05714 alpha-Aminopropiononitrile C06771 Triethanolamine C06772 Diethanolamine Metabolites in cluster 42: C06789 Tetrachloroethene C06790 Trichloroethene C06791 trans-1,2-Dichloroethene C06792 cis-1,2-Dichloroethene C06793 Vinylchloride Metabolites in cluster 43: C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 44: C02880 Protochlorophyllide C04536 Magnesiumprotoporphyrinmonomethylester C11829 131-Hydroxy-magnesium-protoporphyrinIX13-monomethylester C11830 131-Oxo-magnesium-protoporphyrinIX13-monomethylester C11831 Divinylprotochlorophyllide Metabolites in cluster 45: C00843 --Menthone C02485 --Isopiperitenone C09893 Pulegone C11951 +-cis-Isopulegone C11952 +-Isomenthone Metabolites in cluster 46: C08585 Capsorubin C08606 Neoxanthin C08614 Violaxanthin C13431 9'-cis-Neoxanthin C13433 9-cis-Violaxanthin Metabolites in cluster 47: C00156 4-Hydroxybenzoate C02370 4-Chlorobenzoate C06648 4-Chlorobenzaldehyde C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol Metabolites in cluster 48: C06205 1,2-Dihydronaphthalene-1,2-diol C11713 beta-Naphthol C11714 alpha-Naphthol C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide Metabolites in cluster 49: C00009 Orthophosphate C00013 Pyrophosphate C00536 Triphosphate C02466 Trimetaphosphate Metabolites in cluster 50: C00148 L-Proline C00763 D-Proline C01110 5-Amino-2-oxopentanoicacid C03564 1-Pyrroline-2-carboxylate Metabolites in cluster 51: C02916 S-Norlaudanosoline C03758 4-2-Aminoethyl-1,2-benzenediol C07304 Deacetylisoipecoside C07307 Deacetylipecoside Metabolites in cluster 52: C01987 2-Aminophenol C02161 Isophenoxazine C02720 N-Hydroxyarylamine C03824 2-Aminomuconatesemialdehyde Metabolites in cluster 53: C00757 Berberine C01795 Columbamine C03329 S-Canadine C04118 5,8,13,13a-Tetrahydrocolumbamine Metabolites in cluster 54: C01024 Hydroxymethylbilane C01051 UroporphyrinogenIII C03263 CoproporphyrinogenIII C05766 UroporphyrinogenI Metabolites in cluster 55: C00032 Heme C05783 Cytochromea C05784 Catalase C05785 Peroxidase Metabolites in cluster 56: C00331 Indolepyruvate C00637 Indole-3-acetaldehyde C00954 Indole-3-acetate C05835 2-Formaminobenzoylacetate Metabolites in cluster 57: C02226 2-Methylmaleate C02612 R-2-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate Metabolites in cluster 58: C04053 5-Dehydro-4-deoxy-D-glucuronate C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate Metabolites in cluster 59: C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine Metabolites in cluster 60: C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06328 6-Chlorobenzene-1,2,4-triol C06329 2-Chloromaleylacetate Metabolites in cluster 61: C00333 D-Galacturonate C00558 D-Tagaturonate C02273 Digalacturonate C06430 D-Galacturonolactone Metabolites in cluster 62: C01255 N-6-Aminohexanoyl-6-aminohexanoate C02378 6-Aminohexanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C06593 epsilon-Caprolactam Metabolites in cluster 63: C06595 gamma-Hexachlorocyclohexane C06596 gamma-Pentachlorocyclohexene C06597 1,3,4,6-Tetrachloro-1,4-cyclohexadiene C06598 2,4,5-Trichloro-2,5-cyclohexadiene-1-ol Metabolites in cluster 64: C00691 2,4,6/3,5-Pentahydroxycyclohexanone C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid Metabolites in cluster 65: C06714 3-Hydroxypimeloyl-CoA C06723 6-Carboxyhex-2-enoyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 66: C07083 Styrene C07111 Ethylbenzene C07112 1-Phenylethanol C11348 S-1-Phenylethanol Metabolites in cluster 67: C12415 Nogalonicacidmethylester C12417 Auraviketone C12418 Dihydro-NAME C12419 Auramycinone Metabolites in cluster 68: C06082 Abscisate C13454 Xanthoxicacid C13455 Abscisicaldehyde C13456 Abscisicalcohol Metabolites in cluster 69: C13620 TetrabromobisphenolA C13621 TribromobisphenolA C13622 DibromobisphenolA C13623 MonobromobisphenolA Metabolites in cluster 70: C14116 Naphthyl-2-methyl-succinyl-CoA C14117 Naphthyl-2-methylene-succinyl-CoA C14118 Naphthyl-2-hydroxymethyl-succinylCoA C14119 Naphthyl-2-oxomethyl-succinyl-CoA Metabolites in cluster 71: C04188 S-Methyl-5-thio-D-ribose1-phosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate Metabolites in cluster 72: C04525 Fecosterol C15777 Episterol C15780 5-Dehydroepisterol C15781 24-Methylenecholesterol Metabolites in cluster 73: C15900 Spheroidene C15902 Hydroxyspheroidene C15903 Spheroidenone C15905 Hydroxyspheroidenone Metabolites in cluster 74: C01056 S-6-Hydroxynicotine C01297 6-Hydroxypseudooxynicotine C03043 R-6-Hydroxynicotine C15986 2,6-Dihydroxypseudooxynicotine Metabolites in cluster 75: C05418 Cholesterol-5beta,6beta-epoxide C05419 Cholesterol-5alpha,6beta-epoxide C05425 3beta,5alpha,6beta-Cholestanetriol C15992 Cholesterol-5alpha,6alpha-epoxide Metabolites in cluster 76: C06988 beta-1,2,3,4,5,6-Hexachlorocyclohexane C06989 delta-3,4,5,6-Tetrachlorocyclohexene C11352 5,6-Dichloro-1,3-cyclohexadiene C16181 beta-2,3,4,5,6-Pentachlorocyclohexanol Metabolites in cluster 77: C14315 Anthracene C16205 Anthracene-9,10-dihydrodiol C16206 9,10-Dihydroxyanthracene C16207 9,10-Anthraquinone Metabolites in cluster 78: C00786 --Vestitone C10503 --Medicarpin C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16225 --Vestitol Metabolites in cluster 79: C16407 2',4,4',6'-Tetrahydroxychalcone4'-O-glucoside C16408 2',3,4,4',6'-Peptahydroxychalcone4'-O-glucoside C16409 Aureusidin6-O-glucoside C16410 Bracteatin6-O-glucoside Metabolites in cluster 80: C00121 D-Ribose C00216 D-Arabinose C00309 D-Ribulose Metabolites in cluster 81: C00181 D-Xylose C00310 D-Xylulose C00476 D-Lyxose Metabolites in cluster 82: C00612 N1-Acetylspermidine C01029 N8-Acetylspermidine C02567 N1-Acetylspermine Metabolites in cluster 83: C00488 Formamide C01326 Hydrogencyanide C02659 Acetonecyanohydrin Metabolites in cluster 84: C00507 L-Rhamnose C00861 L-Rhamnulose C02431 L-Rhamnofuranose Metabolites in cluster 85: C00479 Propanal C00583 Propane-1,2-diol C02948 4-Hydroxyhexan-3-one Metabolites in cluster 86: C00495 Sulochrin C03036 +-Bisdechlorogeodin C03040 --Bisdechlorogeodin Metabolites in cluster 87: C00234 10-Formyltetrahydrofolate C00445 5,10-Methenyltetrahydrofolate C03479 5-Formyltetrahydrofolate Metabolites in cluster 88: C00193 Aromaticaldehyde C00539 Aromaticacid C03485 Aromaticprimaryalcohol Metabolites in cluster 89: C01075 N-Sulfo-D-glucosamine C03789 N,6-O-Disulfo-D-glucosamine C04674 3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine Metabolites in cluster 90: C00408 L-Pipecolate C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C04076 L-2-Aminoadipate6-semialdehyde Metabolites in cluster 91: C00141 3-Methyl-2-oxobutanoicacid C04039 2,3-Dihydroxy-3-methylbutanoate C04272 R-2,3-Dihydroxy-3-methylbutanoate Metabolites in cluster 92: C00811 4-Coumarate C01197 3,4-Dihydroxy-trans-cinnamate C04366 3-2-Carboxyethenyl-cis,cis-muconate Metabolites in cluster 93: C02504 2S-2-Isopropylmalate C02631 2-Isopropylmaleate C04411 2R,3S-3-Isopropylmalate Metabolites in cluster 94: C04174 trans-2-Decenoyl-acyl-carrierprotein C04180 cis-3-Decenoyl-acyl-carrierprotein C04619 3R-3-Hydroxydecanoyl-acyl-carrierprotein Metabolites in cluster 95: C02741 Phosphoribosyl-AMP C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide Metabolites in cluster 96: C02944 3-cis-Dodecenoyl-CoA C03221 2-trans-Dodecenoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA Metabolites in cluster 97: C03198 S-4-Hydroxymandelate C03590 4-Hydroxyphenylglyoxylate C05343 R-4-Hydroxymandelate Metabolites in cluster 98: C05417 5,6beta-Epoxy-5beta-cholestane C05423 5,6beta-Epoxy-5alpha-cholestane C05424 5alpha-Cholestan-5,6beta-diol Metabolites in cluster 99: C01694 Ergosterol C04416 5alpha-Ergosta-7,22-diene-3beta,5-diol C05441 VitaminD2 Metabolites in cluster 100: C01866 beta-Lactam C03806 Substitutedbeta-aminoacid C05551 PenicillinG Metabolites in cluster 101: C01111 7,8-Dihydroxykynurenate C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate Metabolites in cluster 102: C00780 3-2-Aminoethyl-1H-indol-5-ol C05647 Formyl-5-hydroxykynurenamine C05659 5-Methoxytryptamine Metabolites in cluster 103: C01251 2-Hydroxybutane-1,2,4-tricarboxylate C04002 But-1-ene-1,2,4-tricarboxylate C05662 Homoisocitrate Metabolites in cluster 104: C00827 Lactoyl-CoA C00894 Propenoyl-CoA C05668 3-Hydroxypropionyl-CoA Metabolites in cluster 105: C01708 Hemoglobin C05781 Oxyhemoglobin C05782 Myoglobin Metabolites in cluster 106: C00378 Thiamin C02892 Thiaminaceticacid C05856 Thiaminealdehyde Metabolites in cluster 107: C00116 Glycerol C00969 3-Hydroxypropanal C05999 Lactaldehyde Metabolites in cluster 108: C01880 6-Hexanolide C06101 Hexan-1-ol-6-oate C06103 6-Hydroxyhexanoicacid Metabolites in cluster 109: C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine C06162 Sanguinarine Metabolites in cluster 110: C00755 4-Hydroxy-3-methoxy-benzaldehyde C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C06317 4-Hydroxy-3-methoxy-benzenemethanol Metabolites in cluster 111: C05556 deltaL-2-Aminoadipyl-L-cysteinyl-D-valine C05557 IsopenicillinN C06564 PenicillinN Metabolites in cluster 112: C06639 2,2-Bis4'-chlorophenylethanol C06640 Bis4'-chlorophenylacetate C06642 unsym-Bis4'-chlorophenylethylene Metabolites in cluster 113: C04596 1,1-Dichloro-2,2-bis4-chlorophenylethylene C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate Metabolites in cluster 114: C06674 4-Sulfocatechol C06675 3-Sulfomuconate C06676 4-Sulfolactone Metabolites in cluster 115: C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene Metabolites in cluster 116: C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C04483 3alpha,12alpha-Dihydroxy-5beta-cholanate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate Metabolites in cluster 117: C07271 Limonene-1,2-epoxide C07276 Limonene-1,2-diol C11937 1S,4R-1-Hydroxy-2-oxolimonene Metabolites in cluster 118: C09880 alpha-Pinene C09884 Pinocarvone C11941 Pinocarveol Metabolites in cluster 119: C11945 trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11946 cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11947 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA Metabolites in cluster 120: C12107 AHBA C12108 AminoDHS C12109 AminoDHQ Metabolites in cluster 121: C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12322 dTDP-L-vancosamine Metabolites in cluster 122: C12422 Aklanonicacidmethylester C12423 Aklaviketone C12424 Aklavinone Metabolites in cluster 123: C01907 Daunorubicin C12430 13-Dihydrodaunorubicin C12433 13S-13-Dihydrodaunorubicin Metabolites in cluster 124: C14101 2-Naphthoicacid C14111 5,6,7,8-Tetrahydro-2-naphthoicacid C14113 Decahydro-2-naphthoicacid Metabolites in cluster 125: C12176 ProansamycinX C12246 ProtorifamycinI C14721 34a-Deoxy-rifamycinW Metabolites in cluster 126: C14722 RifamycinW-hemiacetal C14724 Demethyl-desacetyl-rifamycinS C14725 Demethyl-desacetyl-rifamycinSV Metabolites in cluster 127: C06314 LipoxinA4 C06315 LipoxinB4 C14815 5,6-Epoxytetraene Metabolites in cluster 128: C14840 Bromobenzene-2,3-oxide C14841 2-Bromophenol C14842 Bromobenzene-2,3-dihydrodiol Metabolites in cluster 129: C14871 S-Formylmethylglutathione C14874 Glutathioneepisulfoniumion C14875 S-2-Hydroxyethylglutathione Metabolites in cluster 130: C08821 Isofucosterol C15782 delta7-Avenasterol C15783 5-Dehydroavenasterol Metabolites in cluster 131: C15881 Spirilloxanthin C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin Metabolites in cluster 132: C09707 Phaseicacid C15514 8'-Hydroxyabscisate C15971 Dihydrophaseicacid Metabolites in cluster 133: C02505 2-Phenylacetamide C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime Metabolites in cluster 134: C16277 R.g.-KetoI C16279 Thiothece-474 C16280 Okenone Metabolites in cluster 135: C07481 Caffeine C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin Metabolites in cluster 136: C00125 Ferricytochromec C00126 Ferrocytochromec Metabolites in cluster 137: C00067 Formaldehyde C00132 Methanol Metabolites in cluster 138: C00134 Putrescine C00315 Spermidine Metabolites in cluster 139: C00154 Palmitoyl-CoA C00313 Oxalyl-CoA Metabolites in cluster 140: C00019 S-Adenosyl-L-methionine C00170 5'-Methylthioadenosine Metabolites in cluster 141: C00218 Methylamine C02722 N-Methylhexanamide Metabolites in cluster 142: C00247 L-Sorbose C00273 5-Dehydro-D-fructose Metabolites in cluster 143: C00340 Reducedrubredoxin C00435 Oxidizedrubredoxin Metabolites in cluster 144: C00486 Bilirubin C00500 Biliverdin Metabolites in cluster 145: C00259 L-Arabinose C00508 L-Ribulose Metabolites in cluster 146: C00114 Choline C00576 Betainealdehyde Metabolites in cluster 147: C00187 Cholesterol C00599 Cholest-4-en-3-one Metabolites in cluster 148: C00018 Pyridoxalphosphate C00627 Pyridoxinephosphate Metabolites in cluster 149: C00473 Retinol C00899 11-cis-Retinol Metabolites in cluster 150: C00988 2-Phosphoglycolate C06055 O-Phospho-4-hydroxy-L-threonine Metabolites in cluster 151: C00997 Ferricytochromec2 C01000 Ferrocytochromec2 Metabolites in cluster 152: C00619 3-Oxo-delta4-steroid C01034 3-Oxo-delta5-steroid Metabolites in cluster 153: C01097 D-Tagatose6-phosphate C01113 D-Galactose6-phosphate Metabolites in cluster 154: C00779 Scytalone C01173 1,3,8-Naphthalenertriol Metabolites in cluster 155: C00501 CDP-glucose C01219 CDP-4-dehydro-6-deoxy-D-glucose Metabolites in cluster 156: C00708 Iodide C01382 Iodine Metabolites in cluster 157: C00379 Xylitol C01394 Xylose Metabolites in cluster 158: C00261 Benzaldehyde C01408 Benzoin Metabolites in cluster 159: C00423 trans-Cinnamate C01456 Tropate Metabolites in cluster 160: C00115 Chloride C01486 Chlorite Metabolites in cluster 161: C00312 L-Xylulose C01508 L-Lyxose Metabolites in cluster 162: C00084 Acetaldehyde C01548 Acetylene Metabolites in cluster 163: C00519 Hypotaurine C01678 Cysteamine Metabolites in cluster 164: C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01717 4-Hydroxy-2-quinolinecarboxylicacid Metabolites in cluster 165: C01019 6-Deoxy-L-galactose C01721 L-Fuculose Metabolites in cluster 166: C01494 Ferulate C01752 Scopoletin Metabolites in cluster 167: C00810 R-Acetoin C01769 S-Acetoin Metabolites in cluster 168: C01848 RifamycinB C01849 RifamycinO Metabolites in cluster 169: C00927 IsonocardicinA C01941 NocardicinA Metabolites in cluster 170: C00897 alpha-Maltose C01971 beta-Maltose Metabolites in cluster 171: C01983 R-Mandelate C01984 S-Mandelate Metabolites in cluster 172: C01659 Acrylamide C01998 Acrylonitrile Metabolites in cluster 173: C01479 Atropine C02046 L-Hyoscyamine Metabolites in cluster 174: C00601 Phenylacetaldehyde C02083 Styreneoxide Metabolites in cluster 175: C02105 S-Reticuline C02106 S-Scoulerine Metabolites in cluster 176: C01066 Cyclohexane-1,3-dione C02129 5-Oxohexanoicacid Metabolites in cluster 177: C01943 Obtusifoliol C02141 Cycloeucalenol Metabolites in cluster 178: C01351 Donor C02177 Oxidizeddonor Metabolites in cluster 179: C01079 ProtoporphyrinogenIX C02191 Protoporphyrin Metabolites in cluster 180: C01198 3-2-Hydroxyphenylpropanoate C02274 Dihydrocoumarin Metabolites in cluster 181: C01951 Piperitenone C02289 Isopiperitenone Metabolites in cluster 182: C02172 N-Acetylisatin C02298 N-Acetylindoxyl Metabolites in cluster 183: C02235 4-Nitrocatechol C02372 4-Hydroxyaniline Metabolites in cluster 184: C01785 Benzenediol C02389 Benzosemiquinone Metabolites in cluster 185: C00524 Cytochromec C02416 Holocytochromec Metabolites in cluster 186: C02200 UDP-glucosamine C02467 UDP-galactosamine Metabolites in cluster 187: C00123 L-Leucine C02486 3R-beta-Leucine Metabolites in cluster 188: C00477 Ecdysone C02513 3-Dehydroecdysone Metabolites in cluster 189: C01590 Kievitone C02549 Kievitonehydrate Metabolites in cluster 190: C01757 Triacetate C02752 Triacetatelactone Metabolites in cluster 191: C02037 Glycylglycine C02777 2,5-Dioxopiperazine Metabolites in cluster 192: C01839 Orsellinate C02868 Orsellinatedepside Metabolites in cluster 193: C01863 Xanthoaphin C02879 Protoaphinaglucone Metabolites in cluster 194: C02949 4-Hydroxybenzoyl-CoA C06387 4-Chlorobenzoyl-CoA Metabolites in cluster 195: C02117 2-Oxophytanate C02982 L-2-Hydroxyphytanate Metabolites in cluster 196: C01090 16alpha-Hydroxysteroid C03050 16beta-Hydroxysteroid Metabolites in cluster 197: C02411 Glutaconyl-1-CoA C03058 2-Hydroxyglutaryl-CoA Metabolites in cluster 198: C02660 Benzylthiocyanate C03098 Benzylisothiocyanate Metabolites in cluster 199: C00712 9Z-Octadecenoicacid C03195 R-10-Hydroxystearate Metabolites in cluster 200: C01126 2-trans,6-trans-Farnesol C03220 2-cis,6-trans-Farnesol Metabolites in cluster 201: C03178 Tetrahydroxypteridine C03314 Xanthine-8-carboxylate Metabolites in cluster 202: C03374 Bilirubin-glucuronoside C05787 Bilirubinbeta-diglucuronide Metabolites in cluster 203: C03319 dTDP-6-deoxy-L-mannose C03442 dTDP-L-dihydrostreptose Metabolites in cluster 204: C02588 Retinylpalmitate C03455 11-cis-Retinylpalmitate Metabolites in cluster 205: C01593 Limonoate C03514 LimonoateD-ring-lactone Metabolites in cluster 206: C00346 Ethanolaminephosphate C03557 2-Aminoethylphosphonate Metabolites in cluster 207: C01775 Actinomycin C03597 Actinomycinicmonolactone Metabolites in cluster 208: C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose Metabolites in cluster 209: C01171 alpha-D-Hexose1-phosphate C03735 alpha-D-Hexose6-phosphate Metabolites in cluster 210: C03207 16-Dehydroprogesterone C03748 16alpha-Hydroxyprogesterone Metabolites in cluster 211: C01720 L-Fuconate C03827 2-Dehydro-3-deoxy-L-fuconate Metabolites in cluster 212: C01189 5alpha-Cholest-7-en-3beta-ol C03845 5alpha-Cholest-8-en-3beta-ol Metabolites in cluster 213: C01165 L-Glutamate5-semialdehyde C03912 S-1-Pyrroline-5-carboxylate Metabolites in cluster 214: C03871 L-2-Amino-6-oxoheptanedioate C03972 2,3,4,5-Tetrahydrodipicolinate Metabolites in cluster 215: C03239 6-Amino-2-oxohexanoate C04092 delta1-Piperideine-2-carboxylate Metabolites in cluster 216: C03205 11-Deoxycorticosterone C04108 20-Hydroxy-3-oxopregn-4-en-21-al Metabolites in cluster 217: C00318 L-Carnitine C04114 4-Trimethylammoniobut-2-enoate Metabolites in cluster 218: C04073 Heparosan-N-sulfateL-iduronate C04196 Heparosan-N-sulfateD-glucuronate Metabolites in cluster 219: C00483 Tyramine C04227 1-4-Hydroxyphenyl-2-aminoethanol Metabolites in cluster 220: C02027 Deoxylimonate C04251 DeoxylimononicacidD-ring-lactone Metabolites in cluster 221: C03356 3-Phospho-D-erythronate C04309 Phosphoenol-4-deoxy-3-tetrulosonate Metabolites in cluster 222: C01274 5-Formyl-5,6,7,8-tetrahydromethanopterin C04330 5,10-Methenyltetrahydromethanopterin Metabolites in cluster 223: C01711 Inulobiose C04333 Bis-D-fructose2',1:2,1'-dianhydride Metabolites in cluster 224: C02759 alpha-Pinene-oxide C04435 Z-2-Methyl-5-isopropylhexa-2,5-dienal Metabolites in cluster 225: C01089 R-3-Hydroxybutanoate C04546 R-3-R-3-Hydroxybutanoyloxybutanoate Metabolites in cluster 226: C00451 1R,2S-1-Hydroxypropane-1,2,3-tricarboxylate C04617 1S,2S-1-Hydroxypropane-1,2,3-tricarboxylate Metabolites in cluster 227: C04621 E-2-2-Furyl-3-5-nitro-2-furylacrylamide C04622 Z-2-2-Furyl-3-5-nitro-2-furylacrylamide Metabolites in cluster 228: C01161 3,4-Dihydroxyphenylacetate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde Metabolites in cluster 229: C01267 3-Imidazol-4-yl-2-oxopropylphosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate Metabolites in cluster 230: C01291 3-4-Methylpent-3-en-1-yl-pent-2-enedioyl-CoA C04675 3-Hydroxy-3-4-methylpent-3-en-1-ylglutaryl-CoA Metabolites in cluster 231: C01618 Testolate C04676 Testololactone Metabolites in cluster 232: C04685 13E-15S-15-Hydroxy-9-oxoprosta-10,13-dienoate C04686 13E-15S-15-Hydroxy-9-oxoprosta-11,13-dienoate Metabolites in cluster 233: C04793 3,4-Dihydroxy-9,10-secoandrosta-1,3,510-triene-9,17-dione C04844 3-Hydroxy-5,9,17-trioxo-4,5:9,10-disecoandrosta-110,2-dien-4-oate Metabolites in cluster 234: C04843 5Z,9E,14Z-8xi,11xi,12S-8,11,12-Trihydroxyicosa-5,9,14-trienoate C04849 5Z,9E,14Z-8xi,11R,12S-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoicacid Metabolites in cluster 235: C04864 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine4-sulfate C04865 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine6-sulfate Metabolites in cluster 236: C05110 4alpha-Methylcholesta-8-en-3beta-ol C05111 Methostenol Metabolites in cluster 237: C04027 delta1-Pyrroline2-carboxylate C05147 trans-L-3-Hydroxyproline Metabolites in cluster 238: C04798 5-Amino-4-chloro-2-2,3-dihydroxyphenyl-32H-pyridazinone C05155 5-Amino-4-chloro-2-2-hydroxymuconoyl-32H-pyridazinone Metabolites in cluster 239: C05176 S-N-Methylcoclaurine C05202 3'-Hydroxy-N-methyl-S-coclaurine Metabolites in cluster 240: C05229 Phaseollidinhydrate C05230 Phaseollidin Metabolites in cluster 241: C05268 S-Hydroxyhexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA Metabolites in cluster 242: C05258 S-3-Hydroxyhexadecanoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA Metabolites in cluster 243: C05260 S-3-Hydroxytetradecanoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA Metabolites in cluster 244: C05264 S-Hydroxydecanoyl-CoA C05275 trans-Dec-2-enoyl-CoA Metabolites in cluster 245: C05266 S-Hydroxyoctanoyl-CoA C05276 trans-Oct-2-enoyl-CoA Metabolites in cluster 246: C05277 S-3-Hydroxycapryloyl-CoA C05278 R-3-Hydroxycapryloyl-CoA Metabolites in cluster 247: C05279 trans,cis-Lauro-2,6-dienoyl-CoA C05280 cis,cis-3,6-Dodecadienoyl-CoA Metabolites in cluster 248: C05294 19-Hydroxytestosterone C05295 19-Oxotestosterone Metabolites in cluster 249: C05332 Phenethylamine C06746 N-Acetylphenylethylamine Metabolites in cluster 250: C00282 Hydrogen C05359 e- Metabolites in cluster 251: C05413 Phytoene C05414 Phytofluene Metabolites in cluster 252: C05437 Zymosterol C05439 5alpha-Cholesta-7,24-dien-3beta-ol Metabolites in cluster 253: C01753 Sitosterol C05442 Stigmasterol Metabolites in cluster 254: C01164 Cholesta-5,7-dien-3beta-ol C05443 VitaminD3 Metabolites in cluster 255: C05447 3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA C05448 3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA Metabolites in cluster 256: C05450 3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA C05460 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA Metabolites in cluster 257: C05122 Taurocholate C05463 Taurodeoxycholate Metabolites in cluster 258: C00487 Carnitine C05543 3-Dehydroxycarnitine Metabolites in cluster 259: C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate Metabolites in cluster 260: C01598 Melatonin C05642 Formyl-N-acetyl-5-methoxykynurenamine Metabolites in cluster 261: C02470 Xanthurenicacid C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate Metabolites in cluster 262: C05652 4-2-Amino-5-hydroxyphenyl-2,4-dioxobutanoate C05663 6-Hydroxykynurenate Metabolites in cluster 263: C05677 Lipophosphonoglycan C05678 1-Hydroxy-2-aminoethylphosphonate Metabolites in cluster 264: C00227 Acetylphosphate C05682 Phosphonoacetate Metabolites in cluster 265: C05688 Selenocysteine C05704 Selenocystine Metabolites in cluster 266: C05698 Selenohomocysteine C05707 Selenohomocystine Metabolites in cluster 267: C05802 2-Hexaprenyl-6-methoxyphenol C05803 2-Hexaprenyl-6-methoxy-1,4-benzoquinone Metabolites in cluster 268: C02730 2-Succinylbenzoate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate Metabolites in cluster 269: C05838 cis-2-Hydroxycinnamate C05851 Coumarin Metabolites in cluster 270: C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C05938 L-4-Hydroxyglutamatesemialdehyde Metabolites in cluster 271: C03069 3-Methylcrotonyl-CoA C05998 3-Hydroxyisovaleryl-CoA Metabolites in cluster 272: C02170 Methylmalonate C06002 S-Methylmalonatesemialdehyde Metabolites in cluster 273: C00671 S-3-Methyl-2-oxopentanoicacid C06007 R-2,3-Dihydroxy-3-methylpentanoate Metabolites in cluster 274: C04773 3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate C06052 5-Pyridoxolactone Metabolites in cluster 275: C00169 Carbamoylphosphate C06059 Cyclicamidines Metabolites in cluster 276: C04718 1,6,6-Trimethyl-2,7-dioxabicyclo3.2.2nonan-3-one C06066 4,5-Dihydro-5,5-dimethyl-4-3-oxobutylfuran-23H-onehexanoate Metabolites in cluster 277: C06067 Dimethylallyltryptophan C06068 Elymoclavine Metabolites in cluster 278: C06102 Adipatesemialdehyde C06105 Cyclohexan-1,2-dione Metabolites in cluster 279: C01120 Sphinganine1-phosphate C06124 Sphingosine1-phosphate Metabolites in cluster 280: C00164 Acetoacetate C06144 3-Butynoate Metabolites in cluster 281: C05316 Dihydromacarpine C06165 Macarpine Metabolites in cluster 282: C06171 7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-5_-morphinan-6-one C06172 Neopinone Metabolites in cluster 283: C00783 Tropinone C06179 Hygrine Metabolites in cluster 284: C02718 N-Formiminoglycine C06195 Imidazolone Metabolites in cluster 285: C02059 Phylloquinone C06245 Phylloquinol Metabolites in cluster 286: C05194 Dihydrochelirubine C06327 Chelirubine Metabolites in cluster 287: C06390 16-alpha-Hydroxypregnenolone C06392 16,17-Didehydropregnenolone Metabolites in cluster 288: C06395 Protein-L-serine C06396 Protein-D-serine Metabolites in cluster 289: C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose Metabolites in cluster 290: C06399 Hydrogenobyrinate C06408 Precorrin8X Metabolites in cluster 291: C06231 Ectoine C06442 N-gamma-Acetyldiaminobutyrate Metabolites in cluster 292: C06452 2-Hydroxypropylphosphonate C06454 Phosphonomycin Metabolites in cluster 293: C06486 6R-6-L-erythro-1,2-Dihydroxypropyl-5,6,7,8-tetrahydro-4a-hydroxypterin C06487 6R-6-L-erythro-1,2-Dihydroxypropyl-7,8-dihydro-6H-pterin Metabolites in cluster 294: C01380 Ethyleneglycol C06548 Ethyleneoxide Metabolites in cluster 295: C03206 12-Dehydrotetracycline C06624 Oxytetracycline Metabolites in cluster 296: C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06631 dTDP-beta-L-mycarose Metabolites in cluster 297: C01912 Erythromycin C06634 ErythromycinE Metabolites in cluster 298: C04623 1,1,1-Trichloro-2,2-bis4-chlorophenylethane C06649 cis-2,3-Dihydrodiol1,1,1-Trichloro-2,2-bis4'-chlorophenylethane Metabolites in cluster 299: C06650 2,3-Dihydroxy1,1,1-Trichloro-2,2-bis4'-chlorophenylethane C06651 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8,8-tetrachloroocta-2E,4E-dienoate Metabolites in cluster 300: C06661 Clavulanate-9-aldehyde C06662 Clavulanicacid Metabolites in cluster 301: C07090 Protoanemonin C07091 cis-Acetylacrylate Metabolites in cluster 302: C07113 Acetophenone C07189 2-Hydroxyacetophenone Metabolites in cluster 303: C07299 Cutin C07300 Cutinmonomer Metabolites in cluster 304: C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone Metabolites in cluster 305: C00281 Sedoheptulose7-phosphate C07836 D-glycero-D-manno-Heptose7-phosphate Metabolites in cluster 306: C03103 Cyclobutadipyrimidine C08249 Pyrimidine5'-deoxynucleotide Metabolites in cluster 307: C08579 Antheraxanthin C08584 Capsanthin Metabolites in cluster 308: C09024 Ajmalicine C09241 Serpentine Metabolites in cluster 309: C00766 Flavanone C09321 2'-Hydroxychalcone Metabolites in cluster 310: C08578 Butein C09614 Butin Metabolites in cluster 311: C01378 Fustin C09736 Fisetinidol-4beta-ol Metabolites in cluster 312: C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 313: C01063 6-Carboxyhexanoyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA Metabolites in cluster 314: C09814 Benzonitrile C09815 Benzamide Metabolites in cluster 315: C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA Metabolites in cluster 316: C01562 Calycosin C10522 Pseudobaptigenin Metabolites in cluster 317: C06178 1-Methylpyrrolinium C10974 4-Methylaminobutanal Metabolites in cluster 318: C09844 1,8-Cineole C11393 --alpha-Terpineol Metabolites in cluster 319: C01767 --Carvone C11395 4R,6R-cis-Carveol Metabolites in cluster 320: C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate Metabolites in cluster 321: C11417 3S-6-Hydroxy-3-isopropenyl-heptanoate C11419 3S-3-Isopropenyl-6-oxoheptanoate Metabolites in cluster 322: C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol Metabolites in cluster 323: C06331 2-Methylquinoline-3,4-diol C11504 3-Hydroxy-2-methyl-1H-quinolin-4-one Metabolites in cluster 324: C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide Metabolites in cluster 325: C01204 myo-Inositolhexakisphosphate C11526 5-PP-InsP5 Metabolites in cluster 326: C05773 Cobyrinate C11545 Cobalt-precorrin8 Metabolites in cluster 327: C02151 Geissoschizine C11632 Polyneuridinealdehyde Metabolites in cluster 328: C11633 16-Epivellosimine C11634 Vellosimine Metabolites in cluster 329: C07201 Vinblastine C11641 3',4'-Anhydrovinblastine Metabolites in cluster 330: C01512 Loganate C11672 10-Deoxygeniposidicacid Metabolites in cluster 331: C04578 16-Methoxy-2,3-dihydro-3-hydroxytabersonine C11675 16-Methoxytabersonine Metabolites in cluster 332: C09337 Ankorine C11816 Protoemetine Metabolites in cluster 333: C05306 Chlorophylla C11850 Divinylchlorophylla Metabolites in cluster 334: C06096 GibberellinA29 C11855 GibberellinA29-catabolite Metabolites in cluster 335: C11859 GibberellinA37openlactone C11862 GibberellinA36 Metabolites in cluster 336: C11854 GibberellinA51-catabolite C11865 GibberellinA51 Metabolites in cluster 337: C11863 GibberellinA9 C11866 2,3-Dehydro-gibberellinA9 Metabolites in cluster 338: C11864 GibberellinA4 C11867 GibberellinA7 Metabolites in cluster 339: C11868 GibberellinA34 C11869 GibberellinA34-catabolite Metabolites in cluster 340: C03579 2beta-Hydroxygibberellin1 C11870 GibberellinA8-catabolite Metabolites in cluster 341: C02035 GibberellinA20 C11871 GibberellinA5 Metabolites in cluster 342: C11884 Neoabietinol C11885 Neoabietal Metabolites in cluster 343: C11883 Levopimarinol C11886 Levopimarinal Metabolites in cluster 344: C11882 Abietinol C11887 Abietal Metabolites in cluster 345: C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose Metabolites in cluster 346: C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose Metabolites in cluster 347: C11929 Perillyl-CoA C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA Metabolites in cluster 348: C11935 4-Isopropenyl-2-oxy-cyclohexanecarboxyl-CoA C11936 3-Isopropenylpimelyl-CoA Metabolites in cluster 349: C06428 5Z,8Z,11Z,14Z,17Z-Icosapentaenoicacid C12083 5Z,7E,9E,14Z,17Z-Eicosapentaenoicacid Metabolites in cluster 350: C12213 Kanosamine6-phosphate C12214 Aminofructose6-phosphate Metabolites in cluster 351: C12366 TetracenomycinF2 C12367 TetracenomycinF1 Metabolites in cluster 352: C12396 Tetrangomycin C12397 Tetrangulol Metabolites in cluster 353: C12410 UrdamycinoneF C12412 Aquayamycin Metabolites in cluster 354: C12431 13-Dihydrocarminomycin C12432 Carminomycin Metabolites in cluster 355: C12434 S-DNPA C12435 5-Deoxodihydrokalafungin Metabolites in cluster 356: C12436 Dihydrokalafungin C12437 Medermycin Metabolites in cluster 357: C10858 Ecgonine C12449 Pseudoecgonine Metabolites in cluster 358: C06181 Piperideine C12455 5-Aminopentanal Metabolites in cluster 359: C12456 3-Dimethylallyl-4-hydroxyphenylpyruvate C12457 3-Dimethylallyl-4-hydroxymandelicacid Metabolites in cluster 360: C12831 3,4,6-Trichlorocatechol C12833 2,3,5-Trichloro-cis,cis-muconate Metabolites in cluster 361: C12834 2,5-Dichloro-carboxymethylenebut-2-en-4-olide C12835 2,5-Dichloro-4-oxohex-2-enedioate Metabolites in cluster 362: C13626 5-HydroxybisphenolA C13628 4,5-Bisphenol-o-quinone Metabolites in cluster 363: C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene Metabolites in cluster 364: C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13633 2,2-Bis4-hydroxyphenyl-propanoicacid Metabolites in cluster 365: C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid Metabolites in cluster 366: C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA Metabolites in cluster 367: C06006 S-2-Aceto-2-hydroxybutanoate C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate Metabolites in cluster 368: C12044 Rifamycin C14540 RifamycinS Metabolites in cluster 369: C14602 3-Hydroxyaminophenol C14604 Aminohydroquinone Metabolites in cluster 370: C12247 RifamycinW C14723 RifamycinZ Metabolites in cluster 371: C14768 5,6-EET C14772 5,6-DHET Metabolites in cluster 372: C14769 8,9-EET C14773 8,9-DHET Metabolites in cluster 373: C14770 11,12-EET C14774 11,12-DHET Metabolites in cluster 374: C14771 14,15-EET C14775 14,15-DHET Metabolites in cluster 375: C02617 1,4-Naphthoquinone C14785 1,4-Dihydroxynaphthalene Metabolites in cluster 376: C14788 1-Nitrosonaphthalene C14789 N-Hydroxy-1-aminonaphthalene Metabolites in cluster 377: C14800 1-Nitronaphthalene-5,6-oxide C14801 1-Nitro-5,6-dihydroxy-dihydronaphthalene Metabolites in cluster 378: C14818 Fe2+ C14819 Fe3+ Metabolites in cluster 379: C14825 910-EpOME C14828 9,10-DHOME Metabolites in cluster 380: C14826 1213-EpOME C14829 12,13-DHOME Metabolites in cluster 381: C14556 9-Hydroxybenzoapyrene C14849 Benzoapyrene-9,10-oxide Metabolites in cluster 382: C14850 Benzoapyrene-7,8-oxide C14852 Benzoapyrene-7,8-diol Metabolites in cluster 383: C14858 2,2-Dichloroacetaldehyde C14860 2,2-Dichloro-1,1-ethanediol Metabolites in cluster 384: C06899 Chloralhydrate C14866 Chloral Metabolites in cluster 385: C11148 TCEepoxide C14867 Dichloroacetylchloride Metabolites in cluster 386: C03160 2-Succinylbenzoyl-CoA C15547 1,4-Dihydroxy-2-naphthoyl-CoA Metabolites in cluster 387: C01794 Choloyl-CoA C15560 Deoxycholoyl-CoA Metabolites in cluster 388: C15568 7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate C15569 12alpha-Hydroxy-3-oxochola-4,6-dienoate Metabolites in cluster 389: C00525 D-Tryptophan C15605 N-Formyl-D-kynurenine Metabolites in cluster 390: C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole Metabolites in cluster 391: C00555 4-Aminobutanal C15668 1-Pyrroline Metabolites in cluster 392: C11522 24-Methylenelophenol C15776 4alpha-Methylfecosterol Metabolites in cluster 393: C01789 Campesterol C15784 Campest-4-en-3beta-ol Metabolites in cluster 394: C15786 5alpha-Campestan-3-one C15787 Campestanol Metabolites in cluster 395: C15788 6alpha-Hydroxycampestanol C15789 6-Oxocampestanol Metabolites in cluster 396: C15795 22alpha-Hydroxy-campesterol C15796 22alpha-Hydroxy-campest-4-en-3-one Metabolites in cluster 397: C02646 4-Coumarylalcohol C15804 p-Hydroxyphenyllignin Metabolites in cluster 398: C00590 Coniferylalcohol C15805 Guaiacyllignin Metabolites in cluster 399: C02325 Sinapylalcohol C15806 Syringyllignin Metabolites in cluster 400: C12205 5-Hydroxyconiferylalcohol C15807 5-Hydroxy-guaiacyllignin Metabolites in cluster 401: C15814 C15814 C15815 C15815 Metabolites in cluster 402: C15877 Anhydrorhodovibrin C15878 Rhodovibrin Metabolites in cluster 403: C14151 delta-Tocopherol C15882 2-Methyl-6-phytylquinol Metabolites in cluster 404: C02483 gamma-Tocopherol C15883 2,3-Dimethyl-5-phytylquinol Metabolites in cluster 405: C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin Metabolites in cluster 406: C15928 4-Ketomyxol C15932 4-Hydroxymyxol Metabolites in cluster 407: C16001 Reactiveblack5 C16002 Oxidizedreactiveblack5 Metabolites in cluster 408: C16014 cis-Stilbeneoxide C16015 +-1R,2R-1,2-Diphenylethane-1,2-diol Metabolites in cluster 409: C16144 Dehydrosqualene C16145 4,4'-Diaponeurosporene Metabolites in cluster 410: C16188 7-Hydroxy-2',4',5'-trimethoxyisoflavone C16189 9-Demethylmunduserone Metabolites in cluster 411: C00858 Formononetin C16190 2,7-Dihydroxy-4'-methoxyisoflavanone Metabolites in cluster 412: C16193 1,6-Naphthalenedisulfonicacid C16194 2,6-Naphthalenedisulfonicacid Metabolites in cluster 413: C16196 1,2-Dihydroxynaphthalene-6-sulfonate C16198 Z-4-2-Hydroxy-5-sulfonatophenyl-2-oxo-3-butenoate Metabolites in cluster 414: C16212 3-Hydroxy-2-naphthoate C16214 3-6-Carboxymethylenecyclohexa-2,4-dien-1-ylidene-2-oxopropanate Metabolites in cluster 415: C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA Metabolites in cluster 416: C14314 4',6,7-Trihydroxyisoflavone C16233 2,6,7,4'-Tetrahydroxyisoflavanone Metabolites in cluster 417: C04178 3,5-Dibromo-4-hydroxybenzonitrile C16246 3,5-Dibromo-4-hydroxybenzamide Metabolites in cluster 418: C06719 Dihydrophloroglucinol C16272 3-Hydroxy-5-oxohexanoate Metabolites in cluster 419: C05434 beta-Zeacarotene C16291 7,8-Dihydro-beta-carotene Metabolites in cluster 420: C16309 Traumatin C16311 12-Oxo-9Z-dodecenoicacid Metabolites in cluster 421: C16328 trans-2-Enoyl-OPC8-CoA C16329 3-Hydroxy-OPC8-CoA Metabolites in cluster 422: C16332 trans-2-Enoyl-OPC6-CoA C16333 3-Hydroxy-OPC6-CoA Metabolites in cluster 423: C16336 trans-2-Enoyl-OPC4-CoA C16337 3-Hydroxy-OPC4-CoA Metabolites in cluster 424: C16353 7-Methylxanthine C16355 7-Methyluricacid Metabolites in cluster 425: C13747 1,7-Dimethylxanthine C16356 1,7-Dimethyluricacid Metabolites in cluster 426: C16358 1-Methylxanthine C16359 1-Methyluricacid Metabolites in cluster 427: C07480 Theobromine C16360 3,7-Dimethyluricacid Metabolites in cluster 428: C16374 2E,6Z,9Z,12Z,15Z,18Z,21Z-Tetracosahepta-2,6,9,12,15,18,21-enoyl-CoA C16375 6Z,9Z,12Z,15Z,18Z,21Z-3-Hydroxytetracosahexa-6,9,12,15,18,21-enoyl-CoA Metabolites in cluster 429: C16387 2E,6Z,9Z,12Z,15Z,18Z-Tetracosahexa-2,6,9,12,15,18-enoyl-CoA C16388 6Z,9Z,12Z,15Z,18Z-3-Hydroxytetracosapenta-6,9,12,15,18-enoyl-CoA Metabolites in cluster 430: C09827 Pinocembrin C16404 Pinocembrinchalcone Metabolites in cluster 431: C09756 Homoeriodictyol C16405 Homoeriodictyolchalcone Metabolites in cluster 432: C16402 2,4-Dihydroxylamino-6-nitrotoluene C16414 2-Amino-5-hydroxyl-4-hydroxylamino-6-nitrotoluene Metabolites in cluster 433: C09751 Garbanzol C16415 5-Deoxyleucopelargonidin Metabolites in cluster 434: C09789 Naringin C16423 Naringinchalcone datasetS2/relaxed/0000755000175000017500000000000010747436025013726 5ustar oliveroliverdatasetS2/relaxed/reaction_list.txt0000644000175000017500000012204510747436025017332 0ustar oliveroliverR00002 R00004 R00005 R00006 R00008 R00009 R00010 R00011 R00012 R00013 R00014 R00015 R00016 R00017 R00018 R00019 R00021 R00022 R00023 R00024 R00025 R00026 R00027 R00028 R00029 R00031 R00032 R00033 R00034 R00035 R00036 R00038 R00039 R00040 R00042 R00043 R00044 R00045 R00047 R00048 R00049 R00053 R00054 R00055 R00058 R00059 R00060 R00061 R00062 R00063 R00064 R00066 R00067 R00068 R00069 R00070 R00072 R00073 R00074 R00075 R00076 R00077 R00078 R00080 R00081 R00082 R00083 R00084 R00085 R00086 R00087 R00088 R00089 R00090 R00091 R00092 R00093 R00094 R00095 R00097 R00099 R00100 R00101 R00102 R00103 R00104 R00105 R00106 R00107 R00108 R00109 R00111 R00112 R00113 R00114 R00115 R00116 R00118 R00119 R00120 R00121 R00122 R00123 R00124 R00125 R00126 R00127 R00128 R00129 R00130 R00131 R00132 R00134 R00136 R00137 R00138 R00139 R00140 R00143 R00148 R00149 R00150 R00152 R00153 R00155 R00156 R00157 R00158 R00159 R00160 R00161 R00173 R00174 R00175 R00177 R00178 R00179 R00180 R00181 R00182 R00183 R00184 R00185 R00186 R00187 R00188 R00189 R00190 R00191 R00192 R00193 R00194 R00195 R00196 R00197 R00198 R00199 R00200 R00203 R00205 R00206 R00207 R00208 R00209 R00210 R00211 R00212 R00213 R00214 R00215 R00216 R00217 R00218 R00219 R00220 R00221 R00223 R00224 R00226 R00227 R00228 R00229 R00230 R00233 R00235 R00236 R00237 R00238 R00239 R00240 R00241 R00243 R00245 R00248 R00250 R00251 R00253 R00254 R00256 R00257 R00258 R00259 R00260 R00261 R00262 R00264 R00265 R00267 R00268 R00269 R00270 R00271 R00272 R00273 R00274 R00275 R00276 R00277 R00278 R00279 R00280 R00281 R00282 R00283 R00284 R00286 R00287 R00289 R00291 R00293 R00294 R00295 R00296 R00297 R00298 R00299 R00300 R00301 R00302 R00303 R00304 R00305 R00306 R00307 R00310 R00311 R00312 R00313 R00314 R00315 R00316 R00317 R00318 R00319 R00320 R00321 R00322 R00324 R00325 R00326 R00327 R00328 R00330 R00332 R00335 R00336 R00337 R00338 R00339 R00340 R00341 R00342 R00343 R00344 R00345 R00346 R00347 R00348 R00350 R00351 R00352 R00353 R00354 R00355 R00356 R00357 R00359 R00360 R00361 R00362 R00363 R00364 R00365 R00366 R00367 R00368 R00369 R00370 R00371 R00372 R00373 R00374 R00381 R00382 R00396 R00397 R00398 R00399 R00400 R00401 R00402 R00405 R00406 R00407 R00408 R00409 R00410 R00411 R00412 R00414 R00415 R00416 R00418 R00419 R00420 R00421 R00422 R00423 R00424 R00425 R00426 R00428 R00429 R00430 R00431 R00432 R00434 R00445 R00446 R00447 R00448 R00449 R00451 R00452 R00453 R00454 R00457 R00458 R00459 R00460 R00461 R00462 R00463 R00465 R00466 R00468 R00469 R00470 R00471 R00472 R00473 R00474 R00475 R00476 R00477 R00478 R00479 R00480 R00481 R00482 R00483 R00484 R00485 R00486 R00487 R00488 R00489 R00490 R00491 R00494 R00497 R00499 R00500 R00501 R00502 R00503 R00504 R00505 R00507 R00508 R00509 R00510 R00511 R00512 R00513 R00514 R00515 R00516 R00517 R00518 R00519 R00521 R00522 R00524 R00525 R00526 R00527 R00528 R00529 R00530 R00531 R00532 R00533 R00534 R00535 R00536 R00537 R00548 R00549 R00550 R00551 R00552 R00554 R00555 R00556 R00557 R00558 R00559 R00562 R00563 R00565 R00566 R00567 R00568 R00569 R00570 R00571 R00572 R00573 R00574 R00575 R00576 R00578 R00579 R00580 R00581 R00582 R00584 R00585 R00586 R00588 R00589 R00590 R00602 R00603 R00604 R00605 R00606 R00608 R00609 R00610 R00611 R00612 R00614 R00615 R00616 R00617 R00618 R00619 R00621 R00622 R00640 R00642 R00643 R00644 R00645 R00646 R00647 R00648 R00649 R00650 R00651 R00652 R00653 R00654 R00655 R00656 R00657 R00658 R00659 R00660 R00661 R00662 R00664 R00665 R00666 R00667 R00668 R00669 R00670 R00671 R00672 R00673 R00674 R00675 R00676 R00677 R00678 R00679 R00681 R00682 R00683 R00684 R00685 R00686 R00687 R00688 R00689 R00690 R00691 R00692 R00693 R00694 R00695 R00697 R00698 R00699 R00700 R00702 R00703 R00704 R00705 R00706 R00707 R00708 R00709 R00710 R00711 R00713 R00714 R00715 R00716 R00717 R00718 R00719 R00720 R00722 R00723 R00724 R00725 R00726 R00727 R00728 R00729 R00730 R00731 R00732 R00733 R00734 R00735 R00736 R00737 R00739 R00740 R00742 R00743 R00744 R00746 R00747 R00748 R00749 R00750 R00751 R00753 R00754 R00755 R00756 R00758 R00760 R00761 R00762 R00763 R00764 R00765 R00766 R00767 R00768 R00769 R00770 R00771 R00772 R00774 R00775 R00776 R00777 R00778 R00781 R00782 R00783 R00784 R00785 R00787 R00789 R00790 R00791 R00792 R00793 R00794 R00796 R00798 R00799 R00800 R00801 R00802 R00803 R00804 R00805 R00806 R00807 R00808 R00809 R00810 R00812 R00813 R00814 R00815 R00816 R00817 R00818 R00819 R00820 R00821 R00822 R00823 R00825 R00827 R00828 R00829 R00830 R00831 R00832 R00833 R00834 R00835 R00836 R00837 R00838 R00839 R00840 R00841 R00842 R00844 R00845 R00846 R00847 R00848 R00849 R00850 R00853 R00854 R00855 R00856 R00858 R00859 R00860 R00861 R00863 R00864 R00865 R00866 R00867 R00868 R00870 R00871 R00872 R00873 R00874 R00875 R00876 R00877 R00878 R00880 R00881 R00883 R00885 R00887 R00888 R00889 R00892 R00893 R00894 R00895 R00896 R00897 R00899 R00900 R00901 R00903 R00904 R00905 R00906 R00907 R00908 R00909 R00910 R00911 R00912 R00913 R00914 R00915 R00916 R00917 R00918 R00919 R00920 R00921 R00922 R00923 R00924 R00925 R00926 R00927 R00928 R00930 R00931 R00932 R00933 R00934 R00935 R00936 R00937 R00939 R00940 R00941 R00942 R00943 R00944 R00945 R00946 R00947 R00948 R00949 R00951 R00952 R00953 R00954 R00955 R00956 R00957 R00959 R00960 R00961 R00962 R00963 R00964 R00965 R00966 R00967 R00968 R00969 R00970 R00973 R00974 R00975 R00976 R00977 R00978 R00979 R00980 R00982 R00983 R00984 R00985 R00986 R00987 R00988 R00989 R00990 R00991 R00992 R00993 R00994 R00995 R00996 R00997 R00998 R00999 R01000 R01001 R01010 R01011 R01012 R01014 R01015 R01016 R01019 R01020 R01021 R01022 R01023 R01025 R01026 R01027 R01028 R01030 R01031 R01032 R01033 R01034 R01036 R01039 R01041 R01043 R01044 R01045 R01047 R01048 R01049 R01050 R01051 R01052 R01053 R01054 R01055 R01056 R01057 R01058 R01059 R01061 R01063 R01064 R01066 R01067 R01068 R01069 R01070 R01071 R01072 R01073 R01074 R01075 R01076 R01077 R01078 R01079 R01080 R01081 R01082 R01083 R01085 R01086 R01087 R01088 R01089 R01090 R01091 R01092 R01093 R01094 R01095 R01096 R01097 R01098 R01099 R01100 R01101 R01103 R01104 R01106 R01108 R01109 R01110 R01111 R01112 R01113 R01115 R01117 R01118 R01120 R01121 R01123 R01126 R01127 R01128 R01130 R01131 R01132 R01134 R01135 R01137 R01138 R01139 R01140 R01142 R01143 R01144 R01145 R01146 R01147 R01148 R01149 R01150 R01151 R01152 R01153 R01154 R01155 R01156 R01157 R01158 R01159 R01160 R01161 R01163 R01164 R01166 R01167 R01168 R01169 R01171 R01172 R01173 R01174 R01175 R01176 R01177 R01178 R01179 R01180 R01181 R01182 R01183 R01184 R01185 R01186 R01187 R01188 R01189 R01190 R01191 R01192 R01193 R01194 R01195 R01196 R01197 R01199 R01200 R01201 R01202 R01203 R01204 R01205 R01207 R01209 R01210 R01211 R01212 R01213 R01214 R01215 R01216 R01217 R01218 R01220 R01221 R01224 R01225 R01226 R01227 R01228 R01229 R01230 R01231 R01232 R01233 R01234 R01238 R01239 R01240 R01241 R01243 R01244 R01245 R01246 R01248 R01249 R01251 R01252 R01253 R01255 R01256 R01257 R01266 R01267 R01268 R01269 R01270 R01271 R01273 R01274 R01277 R01278 R01279 R01280 R01281 R01282 R01283 R01285 R01286 R01287 R01289 R01290 R01291 R01292 R01293 R01294 R01295 R01296 R01297 R01298 R01299 R01300 R01301 R01302 R01303 R01304 R01305 R01306 R01307 R01308 R01322 R01323 R01324 R01325 R01326 R01327 R01329 R01330 R01333 R01334 R01335 R01336 R01353 R01354 R01355 R01357 R01358 R01359 R01360 R01361 R01364 R01365 R01366 R01367 R01370 R01371 R01372 R01373 R01374 R01375 R01376 R01377 R01378 R01381 R01384 R01385 R01386 R01387 R01388 R01390 R01392 R01393 R01394 R01395 R01396 R01397 R01398 R01399 R01400 R01401 R01402 R01408 R01410 R01411 R01412 R01413 R01414 R01415 R01416 R01417 R01418 R01419 R01420 R01421 R01422 R01423 R01424 R01425 R01426 R01427 R01429 R01430 R01431 R01432 R01434 R01437 R01438 R01440 R01441 R01442 R01443 R01444 R01445 R01446 R01447 R01448 R01449 R01450 R01451 R01452 R01453 R01454 R01456 R01457 R01459 R01460 R01463 R01465 R01466 R01467 R01468 R01469 R01470 R01471 R01473 R01474 R01476 R01481 R01482 R01483 R01484 R01485 R01486 R01487 R01488 R01489 R01490 R01491 R01492 R01504 R01505 R01506 R01507 R01508 R01509 R01510 R01511 R01512 R01513 R01514 R01515 R01516 R01517 R01518 R01519 R01520 R01521 R01522 R01523 R01524 R01525 R01526 R01528 R01529 R01530 R01533 R01535 R01536 R01537 R01538 R01540 R01541 R01542 R01543 R01544 R01547 R01548 R01549 R01550 R01553 R01555 R01556 R01557 R01558 R01559 R01560 R01561 R01562 R01563 R01564 R01565 R01566 R01567 R01568 R01569 R01570 R01571 R01573 R01574 R01575 R01576 R01577 R01579 R01580 R01582 R01583 R01584 R01585 R01586 R01587 R01588 R01589 R01590 R01593 R01594 R01595 R01596 R01598 R01599 R01600 R01601 R01602 R01604 R01607 R01608 R01609 R01610 R01611 R01612 R01613 R01614 R01615 R01616 R01617 R01618 R01619 R01620 R01621 R01627 R01628 R01629 R01630 R01631 R01632 R01633 R01634 R01635 R01636 R01637 R01639 R01641 R01644 R01645 R01647 R01648 R01649 R01650 R01651 R01652 R01653 R01654 R01655 R01657 R01658 R01659 R01660 R01662 R01663 R01664 R01665 R01666 R01667 R01668 R01669 R01670 R01676 R01677 R01678 R01679 R01680 R01681 R01682 R01683 R01684 R01685 R01686 R01688 R01689 R01690 R01694 R01695 R01696 R01697 R01698 R01703 R01704 R01707 R01708 R01709 R01710 R01711 R01712 R01713 R01714 R01715 R01716 R01717 R01718 R01719 R01720 R01721 R01722 R01723 R01724 R01725 R01726 R01728 R01730 R01731 R01732 R01734 R01735 R01736 R01737 R01738 R01739 R01740 R01741 R01742 R01745 R01747 R01748 R01749 R01750 R01751 R01752 R01754 R01756 R01757 R01758 R01759 R01761 R01763 R01764 R01766 R01767 R01768 R01769 R01770 R01771 R01773 R01775 R01776 R01777 R01781 R01782 R01784 R01785 R01786 R01787 R01788 R01789 R01793 R01794 R01795 R01803 R01804 R01805 R01806 R01807 R01808 R01809 R01810 R01811 R01812 R01813 R01814 R01815 R01816 R01817 R01818 R01819 R01825 R01826 R01827 R01829 R01830 R01833 R01834 R01835 R01836 R01837 R01838 R01839 R01840 R01841 R01842 R01843 R01844 R01845 R01846 R01847 R01848 R01849 R01850 R01851 R01855 R01856 R01857 R01858 R01859 R01860 R01861 R01863 R01866 R01867 R01868 R01869 R01870 R01872 R01873 R01874 R01876 R01877 R01878 R01879 R01880 R01881 R01882 R01883 R01884 R01885 R01886 R01887 R01888 R01889 R01890 R01892 R01893 R01896 R01898 R01899 R01900 R01901 R01902 R01903 R01904 R01905 R01906 R01908 R01909 R01910 R01911 R01912 R01913 R01914 R01915 R01916 R01917 R01918 R01919 R01920 R01921 R01922 R01923 R01925 R01926 R01927 R01928 R01929 R01930 R01931 R01932 R01933 R01934 R01936 R01937 R01938 R01939 R01940 R01941 R01942 R01943 R01944 R01945 R01946 R01951 R01953 R01954 R01956 R01957 R01959 R01960 R01961 R01962 R01963 R01964 R01965 R01967 R01968 R01969 R01971 R01972 R01973 R01974 R01975 R01976 R01977 R01978 R01980 R01981 R01983 R01984 R01986 R01987 R01989 R01990 R01991 R01992 R01993 R01994 R01995 R01996 R01997 R02000 R02002 R02003 R02004 R02006 R02007 R02008 R02009 R02010 R02011 R02012 R02013 R02032 R02034 R02035 R02036 R02037 R02038 R02047 R02048 R02050 R02058 R02059 R02060 R02061 R02063 R02064 R02065 R02068 R02069 R02071 R02073 R02075 R02076 R02077 R02078 R02079 R02080 R02081 R02082 R02083 R02084 R02085 R02086 R02087 R02088 R02089 R02090 R02091 R02092 R02093 R02094 R02095 R02096 R02097 R02098 R02099 R02100 R02101 R02102 R02103 R02106 R02107 R02113 R02116 R02118 R02119 R02123 R02124 R02125 R02126 R02129 R02130 R02131 R02132 R02133 R02134 R02135 R02136 R02137 R02139 R02141 R02142 R02143 R02144 R02145 R02147 R02148 R02150 R02152 R02153 R02154 R02155 R02156 R02157 R02158 R02159 R02160 R02167 R02168 R02171 R02172 R02173 R02174 R02177 R02178 R02179 R02193 R02194 R02195 R02196 R02197 R02199 R02200 R02201 R02203 R02204 R02205 R02206 R02207 R02208 R02209 R02210 R02211 R02212 R02213 R02214 R02215 R02216 R02217 R02218 R02219 R02220 R02221 R02222 R02223 R02224 R02225 R02226 R02227 R02228 R02229 R02231 R02232 R02233 R02234 R02235 R02236 R02237 R02238 R02243 R02244 R02245 R02246 R02247 R02252 R02253 R02254 R02255 R02256 R02257 R02258 R02259 R02260 R02261 R02262 R02263 R02264 R02265 R02266 R02267 R02268 R02269 R02270 R02271 R02272 R02273 R02274 R02276 R02278 R02279 R02280 R02282 R02283 R02284 R02285 R02286 R02287 R02288 R02291 R02292 R02293 R02294 R02295 R02296 R02297 R02298 R02299 R02300 R02301 R02302 R02303 R02305 R02306 R02307 R02309 R02310 R02311 R02313 R02315 R02317 R02318 R02322 R02323 R02324 R02325 R02326 R02327 R02328 R02329 R02330 R02331 R02332 R02336 R02338 R02339 R02340 R02341 R02342 R02343 R02344 R02345 R02347 R02349 R02350 R02351 R02352 R02353 R02354 R02355 R02356 R02358 R02359 R02363 R02364 R02365 R02367 R02368 R02369 R02370 R02371 R02372 R02373 R02374 R02375 R02376 R02377 R02378 R02379 R02380 R02381 R02382 R02383 R02384 R02385 R02387 R02388 R02389 R02391 R02393 R02394 R02395 R02396 R02397 R02398 R02399 R02401 R02402 R02404 R02405 R02406 R02407 R02408 R02409 R02410 R02411 R02412 R02413 R02414 R02415 R02416 R02417 R02419 R02422 R02423 R02424 R02425 R02426 R02427 R02428 R02429 R02430 R02431 R02433 R02434 R02435 R02436 R02437 R02438 R02439 R02441 R02442 R02443 R02444 R02445 R02446 R02447 R02449 R02450 R02451 R02452 R02453 R02454 R02455 R02456 R02457 R02458 R02460 R02461 R02462 R02463 R02464 R02466 R02467 R02468 R02469 R02470 R02471 R02472 R02473 R02474 R02476 R02477 R02478 R02479 R02480 R02481 R02482 R02484 R02485 R02486 R02487 R02488 R02489 R02490 R02491 R02492 R02493 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R05783 R05784 R05789 R05790 R05791 R05793 R05799 R05800 R05801 R05804 R05805 R05807 R05808 R05809 R05810 R05811 R05812 R05813 R05814 R05815 R05816 R05817 R05818 R05819 R05821 R05822 R05823 R05824 R05825 R05826 R05827 R05828 R05829 R05830 R05831 R05832 R05833 R05834 R05835 R05836 R05838 R05839 R05840 R05841 R05842 R05843 R05844 R05845 R05846 R05847 R05848 R05849 R05850 R05852 R05853 R05854 R05855 R05856 R05857 R05858 R05859 R05860 R05861 R05862 R05863 R05864 R05865 R05866 R05867 R05868 R05869 R05870 R05871 R05872 R05873 R05874 R05875 R05876 R05877 R05878 R05879 R05880 R05881 R05882 R05884 R05885 R05886 R05887 R05888 R05889 R05890 R05891 R05892 R05893 R05894 R05895 R05896 R05897 R05898 R05899 R05900 R06047 R06048 R06054 R06063 R06064 R06117 R06119 R06120 R06126 R06137 R06146 R06154 R06166 R06171 R06180 R06195 R06196 R06223 R06254 R06255 R06256 R06257 R06265 R06266 R06267 R06268 R06269 R06270 R06271 R06272 R06282 R06284 R06286 R06287 R06288 R06291 R06292 R06293 R06294 R06295 R06296 R06297 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R06610 R06611 R06612 R06613 R06614 R06615 R06617 R06618 R06619 R06621 R06622 R06624 R06625 R06626 R06627 R06628 R06629 R06630 R06631 R06632 R06633 R06634 R06649 R06650 R06651 R06652 R06653 R06654 R06655 R06656 R06657 R06658 R06659 R06660 R06661 R06662 R06663 R06664 R06665 R06666 R06667 R06668 R06669 R06670 R06671 R06672 R06673 R06674 R06675 R06676 R06677 R06678 R06679 R06680 R06681 R06682 R06683 R06684 R06685 R06686 R06687 R06688 R06689 R06690 R06691 R06692 R06693 R06694 R06695 R06696 R06697 R06698 R06699 R06700 R06701 R06702 R06703 R06704 R06705 R06706 R06707 R06708 R06709 R06710 R06711 R06712 R06713 R06714 R06715 R06716 R06717 R06718 R06719 R06720 R06721 R06723 R06724 R06725 R06726 R06727 R06728 R06729 R06730 R06731 R06732 R06733 R06734 R06735 R06736 R06737 R06738 R06739 R06740 R06741 R06742 R06743 R06744 R06745 R06750 R06757 R06758 R06759 R06762 R06763 R06766 R06767 R06769 R06770 R06771 R06772 R06773 R06774 R06776 R06777 R06778 R06779 R06780 R06781 R06782 R06783 R06784 R06785 R06786 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R07084 R07085 R07086 R07087 R07088 R07089 R07090 R07091 R07092 R07093 R07094 R07095 R07096 R07097 R07098 R07099 R07100 R07101 R07102 R07103 R07104 R07105 R07106 R07107 R07108 R07109 R07110 R07111 R07112 R07113 R07114 R07115 R07116 R07117 R07118 R07119 R07120 R07121 R07122 R07123 R07124 R07125 R07126 R07127 R07128 R07132 R07133 R07134 R07135 R07136 R07137 R07138 R07139 R07140 R07141 R07142 R07143 R07144 R07145 R07146 R07147 R07148 R07149 R07150 R07151 R07152 R07153 R07154 R07156 R07157 R07159 R07160 R07161 R07163 R07164 R07165 R07167 R07168 R07169 R07170 R07171 R07172 R07173 R07174 R07175 R07177 R07178 R07179 R07181 R07182 R07183 R07184 R07185 R07186 R07187 R07188 R07189 R07190 R07191 R07192 R07193 R07194 R07195 R07196 R07197 R07198 R07199 R07200 R07201 R07202 R07203 R07204 R07205 R07206 R07207 R07208 R07209 R07211 R07212 R07213 R07214 R07215 R07216 R07217 R07218 R07219 R07220 R07221 R07222 R07223 R07224 R07225 R07229 R07230 R07231 R07235 R07236 R07237 R07238 R07239 R07240 R07241 R07242 R07243 R07244 R07245 R07246 R07247 R07248 R07250 R07251 R07252 R07253 R07254 R07257 R07260 R07262 R07263 R07264 R07265 R07266 R07267 R07268 R07269 R07270 R07271 R07272 R07273 R07274 R07276 R07277 R07279 R07280 R07281 R07286 R07287 R07289 R07290 R07294 R07295 R07296 R07298 R07300 R07301 R07302 R07303 R07304 R07305 R07306 R07307 R07311 R07312 R07313 R07315 R07316 R07317 R07318 R07319 R07320 R07321 R07322 R07323 R07324 R07329 R07330 R07331 R07332 R07333 R07337 R07338 R07339 R07340 R07342 R07343 R07344 R07345 R07346 R07347 R07348 R07349 R07350 R07353 R07354 R07355 R07356 R07357 R07358 R07359 R07360 R07361 R07362 R07363 R07364 R07365 R07366 R07367 R07368 R07369 R07370 R07371 R07372 R07373 R07374 R07375 R07378 R07392 R07393 R07394 R07395 R07396 R07399 R07400 R07401 R07402 R07403 R07404 R07405 R07406 R07407 R07408 R07409 R07410 R07411 R07412 R07413 R07414 R07415 R07416 R07417 R07418 R07419 R07420 R07421 R07422 R07423 R07424 R07425 R07426 R07427 R07428 R07429 R07430 R07431 R07432 R07433 R07434 R07436 R07437 R07440 R07441 R07442 R07443 R07444 R07445 R07446 R07447 R07448 R07449 R07450 R07451 R07452 R07453 R07454 R07455 R07456 R07457 R07458 R07459 R07460 R07461 R07462 R07463 R07464 R07465 R07466 R07467 R07468 R07469 R07470 R07471 R07472 R07473 R07474 R07475 R07476 R07477 R07481 R07482 R07483 R07484 R07485 R07486 R07487 R07488 R07489 R07490 R07491 R07492 R07493 R07494 R07495 R07496 R07497 R07498 R07499 R07500 R07501 R07502 R07503 R07504 R07505 R07506 R07507 R07508 R07509 R07510 R07511 R07512 R07513 R07514 R07515 R07516 R07517 R07518 R07519 R07520 R07521 R07522 R07523 R07524 R07525 R07526 R07527 R07528 R07529 R07530 R07531 R07532 R07533 R07534 R07535 R07536 R07537 R07538 R07539 R07540 R07541 R07542 R07543 R07544 R07546 R07548 R07549 R07550 R07551 R07552 R07553 R07554 R07555 R07556 R07557 R07558 R07559 R07560 R07561 R07562 R07563 R07564 R07565 R07566 R07567 R07568 R07569 R07570 R07571 R07572 R07573 R07574 R07575 R07576 R07577 R07582 R07583 R07584 R07585 R07586 R07587 R07588 R07589 R07590 R07591 R07592 R07593 R07594 R07595 R07596 R07597 R07598 R07599 R07601 R07603 R07605 R07612 R07613 R07627 R07629 R07630 R07631 R07632 R07633 R07634 R07636 R07638 R07640 R07641 R07643 R07644 R07645 R07646 R07647 R07648 R07649 R07650 R07651 R07652 R07653 R07654 R07655 R07656 R07657 R07658 R07659 R07660 R07661 R07662 R07663 R07664 R07665 R07666 R07667 R07668 R07669 R07670 R07672 R07673 R07674 R07675 R07676 R07677 R07678 R07679 R07680 R07682 R07683 R07684 R07685 R07686 R07687 R07688 R07689 R07690 R07691 R07692 R07693 R07694 R07695 R07696 R07697 R07698 R07699 R07700 R07701 R07702 R07703 R07704 R07705 R07706 R07707 R07708 R07709 R07710 R07711 R07712 R07713 R07714 R07715 R07716 R07717 R07718 R07719 R07720 R07721 R07722 R07723 R07724 R07725 R07726 R07727 R07728 R07729 R07730 R07731 R07732 R07733 R07734 R07735 R07736 R07737 R07738 R07739 R07740 R07741 R07742 R07743 R07744 R07745 R07746 R07747 R07748 R07749 R07750 R07751 R07752 R07753 R07754 R07755 R07756 R07757 R07758 R07759 R07760 R07761 R07770 R07772 R07773 R07774 R07775 R07776 R07777 R07778 R07779 R07780 R07781 R07782 R07783 R07784 R07785 R07793 R07794 R07795 R07796 R07797 R07798 R07799 R07800 R07801 R07802 R07803 R07804 R07826 R07827 R07828 R07829 R07830 R07831 R07832 R07833 R07834 R07835 R07836 R07837 R07838 R07839 R07840 R07841 R07842 R07843 R07844 R07845 R07846 R07847 R07848 R07849 R07850 R07851 R07852 R07854 R07855 R07856 R07857 R07858 R07861 R07862 R07863 R07864 R07865 R07866 R07867 R07868 R07869 R07870 R07871 R07872 R07873 R07874 R07875 R07876 R07877 R07878 R07879 R07880 R07881 R07882 R07883 R07884 R07885 R07886 R07887 R07888 R07889 R07890 R07891 R07892 R07893 R07894 R07895 R07896 R07897 R07898 R07899 R07900 R07901 R07902 R07903 R07904 R07905 R07906 R07907 R07908 R07909 R07910 R07911 R07912 R07913 R07914 R07915 R07916 R07917 R07918 R07919 R07920 R07921 R07922 R07923 R07924 R07925 R07926 R07927 R07928 R07929 R07930 R07931 R07932 R07933 R07934 R07935 R07936 R07937 R07938 R07939 R07940 R07941 R07942 R07943 R07944 R07945 R07946 R07947 R07948 R07949 R07950 R07951 R07952 R07953 R07954 R07955 R07956 R07957 R07958 R07959 R07960 R07961 R07962 R07963 R07964 R07965 R07966 R07967 R07968 R07969 R07970 R07971 R07972 R07973 R07974 R07975 R07976 R07977 R07978 R07979 R07980 R07981 R07982 R07983 R07984 R07985 R07986 R07987 R07988 R07989 R07990 R07991 R07992 R07993 R07994 R07995 R07996 R07997 R07998 R07999 R08000 R08001 R08002 R08003 R08004 R08005 R08006 R08007 R08008 R08009 R08010 R08011 R08012 R08013 R08014 R08015 R08016 R08017 R08018 R08019 R08020 R08021 R08022 R08023 R08024 R08025 R08026 R08027 R08028 R08029 R08030 R08031 R08032 R08033 R08034 R08035 R08036 R08037 R08038 R08039 R08040 R08041 R08042 R08043 R08044 R08045 R08046 R08047 R08048 R08049 R08050 datasetS2/relaxed/consensus_scopes.txt0000644000175000017500000000247510747436025020073 0ustar oliveroliverConsensus scope of cluster 1 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 2 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 3 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 4 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 5 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 6 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 7 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 8 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 9 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 10 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 11 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 12 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 13 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 14 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 15 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- datasetS2/relaxed/hierarchical_clusters.txt0000644000175000017500000010406310747436025021035 0ustar oliveroliverMetabolites in cluster 1: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00019 S-Adenosyl-L-methionine C00021 S-Adenosyl-L-homocysteine C00023 Iron C00024 Acetyl-CoA C00034 Manganese C00035 GDP C00039(n) C00041 L-Alanine C00042 Succinate C00049 L-Aspartate C00052 UDP-D-galactose C00053 3'-Phosphoadenylylsulfate C00059 Sulfate C00063 CTP C00064 L-Glutamine C00065 L-Serine C00072 Ascorbate C00073 L-Methionine C00077 L-Ornithine C00082 L-Tyrosine C00088 Nitrite C00089 Sucrose C00095 D-Fructose C00096 GDP-mannose C00101 Tetrahydrofolate C00116 Glycerol C00122 Fumarate C00124 D-Galactose C00132 Methanol C00135 L-Histidine C00136 Butanoyl-CoA C00137 myo-Inositol C00138 Reducedferredoxin C00153 Nicotinamide C00155 L-Homocysteine C00159 D-Mannose C00167 UDP-glucuronate C00168 Hydroxypyruvate C00188 L-Threonine C00189 Ethanolamine C00192 Hydroxylamine C00214 Thymidine C00231 D-Xylulose5-phosphate C00242 Guanine C00248 Lipoamide C00259 L-Arabinose C00261 Benzaldehyde C00262 Hypoxanthine C00265 Dithiothreitol C00266 Glycolaldehyde C00280 Androst-4-ene-3,17-dione C00293 Glucose C00294 Inosine C00299 Uridine C00300 Creatine C00305 Magnesium C00318 L-Carnitine C00319 Sphingosine C00329 D-Glucosamine C00337 S-Dihydroorotate C00340 Reducedrubredoxin C00341 Geranyldiphosphate C00345 6-Phospho-D-gluconate C00353 Geranylgeranyldiphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00383 Malonate C00385 Xanthine C00388 1H-Imidazole-4-ethanamine C00389 Quercetin C00391 Calmodulin C00392 Mannitol C00408 L-Pipecolate C00414 Cyclohexanone C00429 5,6-Dihydrouracil C00446 alpha-D-Galactose1-phosphate C00451 1R,2S-1-Hydroxypropane-1,2,3-tricarboxylate C00463 Indole C00472 p-Benzoquinone C00486 Bilirubin C00489 Glutarate C00495 Sulochrin C00510 Oleoyl-CoA C00512 S-BenzoatecoenzymeA C00513 CDP-glycerol C00524 Cytochromec C00541 CobIIalamin C00542 Cystathionine C00565 Trimethylamine C00570 CDP-ethanolamine C00576 Betainealdehyde C00593 Sulfoacetaldehyde C00597 3-Phosphoglycerate C00616 Quercetin3-sulfate C00618 3-Dehydro-L-gulonate C00645 N-Acetyl-D-mannosamine C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00664 5-Formiminotetrahydrofolate C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C00700 XTP C00703 Hg2+ C00704 O2.- C00740 D-Serine C00747 Pyridine C00748 Siroheme C00750 Spermine C00756 1-Octanol C00761 Coniferin C00767 Glucarate C00785 Urocanate C00794 D-Sorbitol C00808 +-Camphor C00823 1-Hexadecanol C00826 L-Arogenate C00830 Oxomalonate C00836 Sphinganine C00839 Tropomyosin C00843 --Menthone C00847 4-Pyridoxate C00855 D-Methionine C00872 Aminomalonate C00884 Homocarnosine C00892 Pregnan-21-ol C00894 Propenoyl-CoA C00902 2-Oxohexanoicacid C00904 Citramalyl-CoA C00908 GentamicinC1a C00918 Chloramphenicol C00923 Ferricytochrome C00924 Ferrocytochrome C00927 IsonocardicinA C00928 Mercaptoethanol C00933 Sinapoylcholine C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00961 Sterigmatocystin C01000 Ferrocytochromec2 C01010 Urea-1-carboxylate C01033 2-Methylbutanoyl-CoA C01045 N-Formyl-L-glutamate C01051 UroporphyrinogenIII C01078 ProcollagenL-proline C01097 D-Tagatose6-phosphate C01100 L-Histidinolphosphate C01119 Oxidizeddithiothreitol C01139 Acetyl-CoAcarboxylase C01143 R-5-Diphosphomevalonate C01225 sn-glycero-3-Phospho-1-inositol C01227 3beta-Hydroxyandrost-5-en-17-one C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01292 3alpha,7alpha-Dihydroxy-12-oxo-5beta-cholanate C01295 5D-5-O-Methyl-2,3,5/4,6-pentahydroxycyclohexanone C01298 1D-1-Guanidino-3-amino-1,3-dideoxy-scyllo-inositol C01308 3-Methyl-2-oxobutanoatedehydrogenaselipoamidephosphate C01328 HO- C01470 Acacetin C01516 Morphine C01561 Calcidiol C01590 Kievitone C01625 Vicianose C01674 Chitobiose C01744 Phloretate C01780 Aldosterone C01789 Campesterol C01821 Isoorientin C01822 KanamycinA C01847 ReducedFMN C01853 Stipitatate C01870 R-Vicianin C01874 2-Iodophenol C01875 2-Undecanone C01893 Biotinamide C01907 Daunorubicin C01909 Dethiobiotin C01929 L-Histidinal C01967 Ubiquinone-9 C02022 D-Erythrulose C02027 Deoxylimonate C02066 Pseudotropine C02074 Raucaffricine C02116 2-Nitropropane C02129 5-Oxohexanoicacid C02172 N-Acetylisatin C02177 Oxidizeddonor C02180 Phenolsulfate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02240 5-Valerolactone C02307 Phosphorylasea C02366 3-Methyloxindole C02372 4-Hydroxyaniline C02373 4-Methylpentanal C02389 Benzosemiquinone C02457 Propane-1,3-diol C02469 UroporphyrinIII C02480 cis,cis-Muconate C02497 2-Butyne-1,4-diol C02504 2S-2-Isopropylmalate C02512 3-Cyano-L-alanine C02519 4-Methoxybenzoate C02527 Butanoylphosphate C02576 Perillylaldehyde C02590 SteroidO-sulfate C02631 2-Isopropylmaleate C02675 DihydrobiochaninA C02682 Ferricytochromec3 C02717 N-Feruloyltyramine C02722 N-Methylhexanamide C02726 N4-Phosphoagmatine C02790 3'-Hydroxyflavonoid C02791 3,4-Dichloroaniline C02811 Anhydrotetracycline C02816 CalmodulinL-lysine C02822 Cortisol21-sulfate C02835 Imidazole-4-acetate C02887 Sinapoylmalate C02906 Dihydromyricetin C02923 2,3-Dihydroxytoluene C02952 5-Oxo-1,2-campholide C02962 D-Allose6-phosphate C02965 D-Hexose6-phosphate C02983 L-2-Methyltryptophan C03003 N-Glucosylnicotinate C03004 N-Hydroxy-L-tyrosine C03024 Reducedflavoprotein C03027 Testosteroneacetate C03029 TransferrinFeII2 C03035 gamma-Linolenoyl-CoA C03047 1,4-Diguanidinobutane C03049 13-Hydroxydocosanoicacid C03067 3-Hydroxybenzaldehyde C03174 S-Succinylglutathione C03187 dTDP-6-deoxy-L-talose C03273 5-Oxopentanoate C03277 Imidazol-5-yl-pyruvate C03453 Z-5-Oxohex-2-enedioate C03485 Aromaticprimaryalcohol C03506 Indoleglycerolphosphate C03527 OxidizedLatialuciferin C03544 Xanthinedehydrogenase C03561 R-3-Hydroxybutanoyl-CoA C03572 2-Chloro-cis,cis-muconate C03673 3-ADP-2-phosphoglycerate C03711 N-Methylphenylethanolamine C03827 2-Dehydro-3-deoxy-L-fuconate C03912 S-1-Pyrroline-5-carboxylate C03915 1-O-Sinapoylbeta-D-glucoside C03925 3,5-Dibromo-4-hydroxybenzoate C03926 3-Dehydro-2-deoxy-D-gluconate C03975 2-Amino-4,7-dihydroxypteridine C04039 2,3-Dihydroxy-3-methylbutanoate C04054 5-Hydroxybenzimidazolylcobamide C04076 L-2-Aminoadipate6-semialdehyde C04079 N-R-Pantothenoyl-L-cysteine C04210 N5-L-1-Carboxyethyl-L-ornithine C04216 all-trans-Heptaprenyldiphosphate C04221 trans-1,2-Dihydrobenzene-1,2-diol C04223 +/--6-Hydroxy-3-oxo-alpha-ionone C04259 Nalpha,Nalpha-Dimethyl-L-histidine C04376 5'-Phosphoribosyl-N-formylglycinamide C04379 9,11alpha-Epoxypregn-4-ene-3,20-dione C04447 3-Carboxy-4-methoxy-N-methyl-2-pyridone C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04453 4alpha-Methyl-5alpha-cholest-7-en-3-one C04454 5-Amino-6-5'-phosphoribitylaminouracil C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04486 5-4-Hydroxybut-1-ynyl-2,2'-bithiophene C04487 5-D-Galactosyloxy-L-lysine-procollagen C04488 5-Methyl-5,6,7,8-tetrahydromethanopterin C04579 Inositol1,2,3,4,5-pentakisphosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C04586 Diethyl2R,3R-2-methyl-3-hydroxysuccinate C04590 sn-3-O-Geranylgeranylglycerol1-phosphate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04619 3R-3-Hydroxydecanoyl-acyl-carrierprotein C04623 1,1,1-Trichloro-2,2-bis4-chlorophenylethane C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04632 Hydroxymethylglutaryl-CoAreductaseNADPH C04634 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate C04638 2,3-Bis-O-geranylgeranylglycerol1-phosphate C04692 2-3-Carboxy-3-methylammoniopropyl-L-histidine C04698 Methyl-2-alpha-L-fucopyranosyl-beta-D-galactoside C04700 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04767 O-1,4-alpha-L-Dihydrostreptosyl-streptidine6-phosphate C04771 S-2-Amino-3-3-hydroxy-4-oxo-4H-pyridin-1-ylpropanoate C04778 N1-5-Phospho-alpha-D-ribosyl-5,6-dimethylbenzimidazole C04780 8-1R,2R-3-Oxo-2-Z-pent-2-enylcyclopentyloctanoate C04793 3,4-Dihydroxy-9,10-secoandrosta-1,3,510-triene-9,17-dione C04833 m7G5'pppm6AmmRNAcontaininganN6,2'-O-dimethyladenosinecap C04851 MurAcoyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala-diphospho-undecaprenol C04853 20-OH-LeukotrieneB4 C05161 2,5-Diaminohexanoate C05269 3-Oxohexanoyl-CoA C05300 16alpha-Hydroxyestrone C05301 2-Hydroxyestradiol-17beta C05306 Chlorophylla C05313 3-Hexaprenyl-4-hydroxy-5-methoxybenzoate C05340 beta-Alanyl-L-arginine C05376 BiochaninA-beta-D-glucoside C05378 beta-D-Fructose1,6-bisphosphate C05379 Oxalosuccinate C05380 Nicotinurate C05381 3-Carboxy-1-hydroxypropyl-ThPP C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05385 D-Glucuronate1-phosphate C05386 GDP-6-deoxy-L-mannose C05394 3-Keto-beta-D-galactose C05479 5beta-Pregnane-3,20-dione C05487 17alpha,21-Dihydroxypregnenolone C05532 SO2 C05544 ProteinN6-methyl-L-lysine C05565 Hydantoin-5-propionate C05578 5,6-Dihydroxyindole C05579 Indole-5,6-quinone C05585 Gentisatealdehyde C05657 6-Hydroxyindolelactate C05669 beta-Nitropropanoate C05717 alpha-Amino-gamma-cyanobutanoate C05730 Glutathionylspermidine C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen C05793 L-Urobilin C05942 Pyrrole-2-carboxylate C05998 3-Hydroxyisovaleryl-CoA C06000 S-3-Hydroxyisobutyryl-CoA C06011 Benzenaminesulfate C06083 Tetrahymanol C06341 7alpha,27-Dihydroxycholesterol C06342 Quinolin-2,8-diol C06359 Ethylcinnamate C06381 Methylenediurea C06578 p-Cumate C06640 Bis4'-chlorophenylacetate C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate C06646 2-4'-Chlorophenyl-3,3-dichloropropenoate C06647 4-Chloroacetophenone C06655 L-N2-2-Carboxyethylarginine C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06723 6-Carboxyhex-2-enoyl-CoA C06725 5,6-Dihydroxy-3-methyl-2-oxo-1,2-dihydroquinoline C06726 5,6-Dihydroxy-3-methyl-2-oxo-1,2,5,6-tetrahydroquinoline C06730 4-Methylcatechol C06731 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate C06732 alpha,beta-Didehydrotryptophan C06733 8'-apo-beta-Carotenol C06791 trans-1,2-Dichloroethene C06792 cis-1,2-Dichloroethene C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C06899 Chloralhydrate C07024 3'-Keto-3'-deoxy-ATP C07026 3'-Amino-3'-deoxy-AMP C07201 Vinblastine C07204 Vincristine C07308 Dimethylarsinate C07331 Carbonylsulfide C07478 2-Hydroxy-5-methyl-cis,cis-muconate C08725 Pelargonin C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA C11419 3S-3-Isopropenyl-6-oxoheptanoate Metabolites in cluster 2: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00011 CO2 C00022 Pyruvate C00025 L-Glutamate C00033 Acetate C00039(n+m) C00081 ITP C00113 PQQ C00134 Putrescine C00140 N-Acetyl-D-glucosamine C00143 5,10-Methylenetetrahydrofolate C00146 Phenol C00149 S-Malate C00164 Acetoacetate C00177 Cyanide C00187 Cholesterol C00197 3-Phospho-D-glycerate C00203 UDP-N-acetyl-D-galactosamine C00212 Adenosine C00223 p-Coumaroyl-CoA C00224 Adenylylsulfate C00234 10-Formyltetrahydrofolate C00245 Taurine C00275 D-Mannose6-phosphate C00281 Sedoheptulose7-phosphate C00371 Zeatin C00387 Guanosine C00439 N-Formimino-L-glutamate C00449 N6-L-1,3-Dicarboxypropyl-L-lysine C00459 dTTP C00497 R-Malate C00498 ADP-glucose C00502 D-Xylonate C00535 Testosterone C00547 L-Noradrenaline C00557 Cyclopentanone C00575 3',5'-CyclicAMP C00582 Phenylacetyl-CoA C00583 Propane-1,2-diol C00601 Phenylacetaldehyde C00612 N1-Acetylspermidine C00617 UDP-D-galacturonate C00619 3-Oxo-delta4-steroid C00725 Lipoate C00739 D-Lysine C00745 Nicotine C00772 Mevaldate C00774 Phloretin C00802 Oxalureate C00803 Pentanoate C00817 D-Altronate C00819 D-Glutamine C00853 CobIalamin C00863 Monoterpenol C00869 2-Oxooctadecanoicacid C00878 D-Arabinonate C00903 Cinnamaldehyde C00919 Cholinesulfate C00935 UDP-L-arabinose C00947 Aromaticalcohol C00999 Ferrocytochromeb5 C01007 Reducedriboflavin C01022 Caldesmonphosphate C01036 4-Maleylacetoacetate C01053 R-4-Dehydropantoate C01069 Desulfoglucotropeolin C01079 ProtoporphyrinogenIX C01087 R-2-Hydroxyglutarate C01155 Quercetin3,3'-bissulfate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01192 Palmitoylglyceronephosphate C01212 UDP-N-acetylmuramoyl-L-alanine C01231 alpha-D-Glucose1,6-bisphosphate C01299 Adenylyl-L-glutamate:ammonialigaseADP-forming C01394 Xylose C01403 Anisole C01433 Loganin C01526 Ricinine C01527 Scopolin C01595 Linoleate C01673 Calcitriol C01709 Hesperetin C01752 Scopoletin C01765 +-Borneol C01766 --Borneol C01785 Benzenediol C01832 Lauroyl-CoA C01857 Thioacetate C01902 Cycloartenol C01912 Erythromycin C01934 L-Rhamnonate C01944 Octanoyl-CoA C01993 5'-Oxoinosine C02015 CoA-disulfide C02031 G5'pppR-RNA C02037 Glycylglycine C02094 beta-Carotene C02107 S,S-Tartaricacid C02126 4-Nitroaniline C02140 Corticosterone C02232 3-Oxoadipyl-CoA C02331 Vinylacetyl-CoA C02350 S+-Allantoin C02360 2-Hydroxyadipate C02432 L-Selenocysteine C02467 UDP-galactosamine C02506 21-Hydroxysteroid C02513 3-Dehydroecdysone C02614 S-2-Methylmalate C02647 4-Guanidinobutanal C02648 4-Hydroxy-2-butynal C02674 Deoxyribonolactone C02684 Ferrocytochromec3 C02700 L-Formylkynurenine C02704 Monomethylsulfate C02710 N-Acetyl-L-leucine C02740 Photinusluciferin C02817 Chlordeconealcohol C02821 Cortisol21-acetate C02823 CyanocobIIIalamin C02914 S-2-O-Sulfolactate C02922 2'-O-Methyllicodione C02934 3-Dehydrosphinganine C02937 3-Indoleacetaldoxime C02939 3-Methylbutanoyl-CoA C02940 3-Oxo-5alpha-steroid C02946 4-Acetamidobutanoate C02993 L-Tyrosyl-L-arginine C02994 L-Xylono-1,4-lactone C03032 alpha-Cyclopiazonate C03087 5-Acetamidopentanoate C03113 Diisopropylphosphate C03166 Phosphoguanidinoacetate C03197 S-3-Hydroxybutanoate C03198 S-4-Hydroxymandelate C03238 5alpha-Cholestan-3-one C03246 ADPribose2'-phosphate C03291 L-Xylulose5-phosphate C03300 O-beta-D-Xylosylzeatin C03302 Oxidizedputidaredoxin C03343 2-Ethylhexylphthalate C03344 2-Methylacetoacetyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03401 L-2,3-Diaminopropanoate C03410 N-Glycoloyl-neuraminate C03486 CDP-N-methylethanolamine C03503 Glucosyloxyanthraquinone C03515 Luteolin7-O-glucuronide C03524 N2'-AcetylgentamicinC1a C03577 20-HydroxyleukotrieneE4 C03589 4-Hydroxy-2-oxopentanoate C03618 L-threo-3-Methylaspartate C03619 Methylbeta-D-galactoside C03622 N-Hydroxy-4-aminobiphenyl C03660 3-O-Methyl-myo-inositol C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03685 7-Methyl-3-oxooctanoyl-CoA C03722 Pyridine-2,3-dicarboxylate C03727 S-Carboxymethyl-L-cysteine C03851 Adenosine5'-phosphoramidate C03897 Quercetin3,3',7-trissulfate C03947 Glycerol1,2-cyclicphosphate C04000 Benzyl2-methyl-3-oxobutanoate C04205 N-3,4-Dichlorophenyl-malonamate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04244 6-Lactoyl-5,6,7,8-tetrahydropterin C04251 DeoxylimononicacidD-ring-lactone C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04462 N-Succinyl-2-L-amino-6-oxoheptanedioate C04468 +-cis-3,4-Dihydrophenanthrene-3,4-diol C04494 Guanosine3'-diphosphate5'-triphosphate C04498 N-4-Guanidinobutyl-4-hydroxycinnamide C04516 1,2,3,6-Tetrakis-O-galloyl-beta-D-glucose C04524 2-Protocatechoylphloroglucinolcarboxylate C04530 4,4-Dimethyl-5alpha-cholest-7-en-3beta-ol C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04536 Magnesiumprotoporphyrinmonomethylester C04546 R-3-R-3-Hydroxybutanoyloxybutanoate C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C04592 Toluene-cis-dihydrodiol C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04676 Testololactone C04715 20S,22S,25S-22,25-Epoxyfurost-5-ene-3beta,26-diol C04785 13S-HPOT C04835 5Z,13E-6,9alpha-Epoxy-11alpha-hydroxy-15-oxoprosta-5,13-dienoate C04840 3beta-Hydroxy-4beta-methyl-5alpha-cholest-7-ene-4alpha-carboxylate C04856 6S-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide C04858 Apigenin7-O-beta-D-apiosyl-1->2-beta-D-glucoside C04864 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine4-sulfate C04865 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine6-sulfate C04875 +/--5-tert-Butylamino-2'-hydroxypropoxy-1,2,3,4-tetrahydro-1-naphthol C04882 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine C04923 1,3-alpha-D-Mannosyl-1,2-N-acetyl-alpha-D-glucosaminyl-1,2-alpha-D-mannosyl-1,2-alpha-D-mannosyl-D-mannose C04932 2,3,2',3'-Tetrakis3-hydroxytetradecanoyl-D-glucosaminyl-1,6-beta-D-glucosamine1-phosphate C05005 Glycolipid C05111 Methostenol C05131 1-Ribosylimidazole-4-acetate C05141 Estriol C05196 Dihydroflavodoxin C05198 5'-Deoxyadenosine C05199 Flavodoxinsemiquinone C05202 3'-Hydroxy-N-methyl-S-coclaurine C05259 3-Oxopalmitoyl-CoA C05270 Hexanoyl-CoA C05274 Decanoyl-CoA C05275 trans-Dec-2-enoyl-CoA C05291 7alpha-Hydroxytestosterone C05411 L-Xylonate C05412 L-Lyxonate C05413 Phytoene C05442 Stigmasterol C05443 VitaminD3 C05444 3alpha,7alpha,26-Trihydroxy-5beta-cholestane C05445 3alpha,7alpha-Dihydroxy-5beta-cholestan-26-al C05446 3alpha,7alpha,12alpha,26-Tetrahydroxy-5beta-cholestane C05447 3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA C05448 3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA C05500 20alpha-Hydroxycholesterol C05502 22beta-Hydroxycholesterol C05503 Estradiol-17beta3-glucuronide C05539 N-Acetyl-L-2-amino-6-oxopimelate C05571 Thiourocanicacid C05575 Hercynine C05576 3,4-Dihydroxyphenylethyleneglycol C05577 3,4-Dihydroxymandelaldehyde C05608 4-Hydroxycinnamylaldehyde C05610 Sinapoylaldehyde C05613 Benzylformate C05616 3-O-Methylgallate C05618 3-Chlorocatechol C05636 3-Hydroxykynurenamine C05638 5-Hydroxykynurenamine C05643 6-Hydroxymelatonin C05677 Lipophosphonoglycan C05684 Selenite C05686 Adenylylselenate C05690 Se-Methylselenomethionine C05693 R C05694 CH3-R C05696 3'-Phosphoadenylylselenate C05697 Selenate C05698 Selenohomocysteine C05701 O-Succinylhomoserine C05702 O-Phosphorylhomoserine C05707 Selenohomocystine C05708 Selenomethioninese-oxide C05821 Enterochelin C05822 3'-CMP C05831 3-Methoxyanthranilate C05941 2-Oxo-4-hydroxy-5-aminovalerate C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C06001 S-3-Hydroxyisobutyrate C06035 4-Methylene-2-oxoglutarate C06073 Indolealkaloid C06084 Hopanoid C06091 Aconitine C06092 Veatchine C06093 GibberellinA12aldehyde C06094 GibberellinA53 C06430 D-Galacturonolactone C06432 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanine C06435 5'-Butyrylphosphoinosine C06456 Phosphonoformate C06457 Bialaphos C06459 N-Trimethyl-2-aminoethylphosphonate C06479 Ketosteroid C06511 Guattegaumerine C06512 2'-Norberbamunine C06569 7a-Hydroxy-o-carbamoyl-deacetylcephalosporinC C06579 cis-2,3-Dihydroxy-2,3-dihydro-p-cumate C06609 trans-1,3-Dichloropropene C06610 cis-1,3-Dichloropropene C06611 trans-3-Chloro-2-propene-1-ol C06625 Malonamoyl-CoA C06629 6-Methylpretetramide C06630 3-O-MycarosylerythronolideB C06631 dTDP-beta-L-mycarose C06635 ErythronolideB C06672 Vanillate C06989 delta-3,4,5,6-Tetrachlorocyclohexene C07095 2,5-Dichloro-cis,cis-muconate C07292 Glutaredoxin C07330 3-Methylbut-2-enal C07349 3'-Demethylstaurosporine C08814 Brassinolide C09337 Ankorine C09421 Emetine C09614 Butin C10126 Anatabine C10175 Quercetin3-2G-xylosylrutinoside C10192 Tricetin C10200 Anhydroglycinol C11383 +-S-Carvone C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate C11480 2-Methyl-6-oxohepta-2,4-dienal Metabolites in cluster 3: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00008 ADP C00015 UDP C00016 FAD C00018 Pyridoxalphosphate C00020 AMP C00027 H2O2 C00032 Heme C00037 Glycine C00039(m) C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00046(m) C00046(n) C00051 Glutathione C00055 CMP C00058 Formate C00061 FMN C00062 L-Arginine C00068 Thiamindiphosphate C00075 UTP C00083 Malonyl-CoA C00084 Acetaldehyde C00087 Sulfur C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00094 Sulfite C00099 beta-Alanine C00100 Propanoyl-CoA C00106 Uracil C00108 Anthranilate C00117 D-Ribose5-phosphate C00119 5-Phospho-alpha-D-ribose1-diphosphate C00130 IMP C00148 L-Proline C00169 Carbamoylphosphate C00178 Thymine C00180 Benzoate C00181 D-Xylose C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00209 Oxalate C00213 Sarcosine C00251 Chorismate C00257 D-Gluconicacid C00267 alpha-D-Glucose C00309 D-Ribulose C00310 D-Xylulose C00313 Oxalyl-CoA C00315 Spermidine C00320 Thiosulfate C00322 2-Oxoadipate C00325 GDP-L-fucose C00326 Glycoprotein C00327 L-Citrulline C00328 L-Kynurenine C00333 D-Galacturonate C00352 D-Glucosamine6-phosphate C00379 Xylitol C00402 D-Aspartate C00410 Progesterone C00411 Sinapoyl-CoA C00412 Stearoyl-CoA C00413 Streptomycin C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00468 Estrone C00517 Hexadecanal C00546 Methylglyoxal C00552 meso-Tartaricacid C00553 +-Neomenthol C00556 Benzylalcohol C00561 Mandelonitrile C00568 4-Aminobenzoate C00577 D-Glyceraldehyde C00580 Dimethylsulfide C00584 ProstaglandinE2 C00587 3-Hydroxybenzoate C00590 Coniferylalcohol C00596 2-Hydroxy-2,4-pentadienoate C00599 Cholest-4-en-3-one C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00624 N-Acetyl-L-glutamate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00716 Serine C00786 --Vestitone C00806 Tryptophan C00845 2-Furoyl-CoA C00852 Chlorogenate C00880 D-Galactonate C00887 Nitrousoxide C00921 Dihydropteroate C00922 2,3-Dimethylmaleate C00971 4-Pyridoxolactone C00988 2-Phosphoglycolate C00991 alpha-D-Aldose1-phosphate C00993 D-Alanyl-D-alanine C00995 Ferricytochromeb1 C00996 Ferricytochromeb5 C01004 N-Methylnicotinate C01008 Trimethylsulfonium C01012 R-Pantolactone C01024 Hydroxymethylbilane C01041 Monodehydroascorbate C01047 N5-Ethyl-L-glutamine C01058 11beta-Hydroxysteroid C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01068 D-Ribitol5-phosphate C01073 N-Acetyl-beta-alanine C01077 O-Acetyl-L-homoserine C01089 R-3-Hydroxybutanoate C01107 R-5-Phosphomevalonate C01109 4-Methylene-L-glutamine C01110 5-Amino-2-oxopentanoicacid C01113 D-Galactose6-phosphate C01118 O-Succinyl-L-homoserine C01121 Streptidine6-phosphate C01124 18-Hydroxycorticosterone C01126 2-trans,6-trans-Farnesol C01141 beta-Adrenergicreceptor C01142 3S-3,6-Diaminohexanoate C01149 4-Trimethylammoniobutanal C01152 Npi-Methyl-L-histidine C01164 Cholesta-5,7-dien-3beta-ol C01176 17alpha-Hydroxyprogesterone C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01863 Xanthoaphin C01877 4-Oxoproline C01882 ADP-D-ribose C01920 Geranoyl-CoA C01921 Glycocholate C01923 Heteroglycan C02046 L-Hyoscyamine C02099 2S-Flavanone C02224 2-Methylcholine C02283 Glycyrrhetinate C02339 m7G5'pppR-RNA C02416 Holocytochromec C02452 Perillylalcohol C02477 alpha-Tocopherol C02705 Mucusglycoprotein C02721 N-Methyl-L-alanine C02723 N-Methylputrescine C02785 3-Hydroxy-vitaminK C02855 N-Phospho-D-lombricine C02880 Protochlorophyllide C02912 R-Propane-1,2-diol C02916 S-Norlaudanosoline C02949 4-Hydroxybenzoyl-CoA C03019 Phorbol13-butanoate C03037 +-Bornane-2,5-dione C03043 R-6-Hydroxynicotine C03070 3-Oxo-5beta-cholanate C03077 4-Chlorophenylacetate C03134 N,N-Dimethylformamide C03178 Tetrahydroxypteridine C03212 2,4-Dihydroxypteridine C03263 CoproporphyrinogenIII C03267 beta-D-Fructose2-phosphate C03283 L-2,4-Diaminobutanoate C03354 3-Methylthiopropanamine C03415 N2-Succinyl-L-ornithine C03422 O-Palmitoylglycoprotein C03459 2-Hydroxy-3-oxosuccinate C03462 3''-Adenylylstreptomycin C03470 3-alphaS-Strictosidine C03476 5,12-Dihydroxanthommatin C03492 D-4'-Phosphopantothenate C03546 myo-Inositol4-phosphate C03585 3-Chloro-cis,cis-muconate C03597 Actinomycinicmonolactone C03614 Inosine5'-tetraphosphate C03640 Sphingosyl-phosphocholine C03671 2-Pyrone-4,6-dicarboxylate C03703 L-5-Carboxymethylhydantoin C03710 N-Benzyloxycarbonylglycine C03767 4-Oxocyclohexanecarboxylate C03771 5-Guanidino-2-oxopentanoate C03832 3,5,3'-Triiodothyropyruvate C03882 N-E,E-Piperoylpiperidine C04018 N-Acetyl-D-galactosaminoglycan C04050 4-HydroxyaminoquinolineN-oxide C04226 6-oxo-1,4,5,6-tetrahydronicotinate C04256 N-Acetyl-D-glucosamine1-phosphate C04271 6aR,11aR-3,9-Dihydroxypterocarpan C04302 N-5-Phospho-D-ribosylanthranilate C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate C04686 13E-15S-15-Hydroxy-9-oxoprosta-11,13-dienoate C04717 9Z,11E-13S-13-Hydroperoxyoctadeca-9,11-dienoicacid C04755 GlycoproteinN-acetyl-D-glucosaminyl-phospho-D-mannose C04758 5Z,13E-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate C04759 1,2-D-Glucosyl-5-D-galactosyloxy-L-lysine-procollagen C04827 Apo-3-methylcrotonoyl-CoA:carbon-dioxideligaseADP-forming C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C04881 N-Acetyl-beta-D-mannosaminyl-1,4-N-acetyl-D-glucosaminyldiphosphoundecaprenol C05127 N-Methylhistamine C05138 17alpha-Hydroxypregnenolone C05139 16alpha-Hydroxydehydroepiandrosterone C05177 Berbamunine C05178 R-Reticuline C05183 Ferrocytochromeb-561 C05189 Protopine C05190 6-Hydroxyprotopine C05194 Dihydrochelirubine C05195 3-Hydroxybenzoyl-CoA C05230 Phaseollidin C05324 Nicotianamine C05325 Purinemononucleotide C05328 D-2-Amino-hexano-6-lactam C05338 4-Hydroxyphenylacetyl-CoA C05590 HI C05966 15S-HPETE C06018 dTDP-4-acetamido-4,6-dideoxy-D-glucose C06025 Di3-deoxy-D-manno-octulosonyl-lipidIVA C06327 Chelirubine C06757 4-Methylbenzylalcohol C07085 3-Vinylcatechol C07345 Betainealdehydehydrate C07347 Thiophene-2-carbonyl-CoA C08578 Butein C08580 Astaxanthin C09248 Tubulosine Metabolites in cluster 4: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C04300 Estradiol-17alpha3-D-glucuronoside C04314 cis-1,2-Dihydronaphthalene-1,2-diol C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04318 11-O-Demethyl-17-O-deacetylvindoline C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C05777 CoenzymeF430 C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C07726 1-Formyl-2-indanone C07727 2-Indanone C07728 3-Isochromanone C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C08249 Pyrimidine5'-deoxynucleotide C08491 --Jasmonicacid C08576 Aureusidin C08577 Bracteatin C10434 5-O-Caffeoylshikimicacid C10469 Isoeugenol C10478 Methylisoeugenol C10502 --Maackiain Metabolites in cluster 5: C00001 H2O C00028 Acceptor C00080 H+ C00086 Urea C00141 3-Methyl-2-oxobutanoicacid C00163 Propanoate C00179 Agmatine C00183 L-Valine C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00230 3,4-Dihydroxybenzoate C00235 Dimethylallyldiphosphate C00246 Butanoicacid C00349 2-Methyl-3-oxopropanoate C00469 Ethanol C00558 D-Tagaturonate C00672 2-Deoxy-D-ribose1-phosphate C00744 Macrocin C00974 Dihydrokaempferol C00986 1,3-Diaminopropane C01046 N-Methyl-L-glutamate C01281 L-Glutamate:ammonialigaseADP-forming C01448 Questin C01697 Galactitol C01735 Morphinone C02137 alpha-Oxo-benzeneaceticacid C02248 Apocytochromec C02405 Formylphosphate C03107 D-Glucono-1,4-lactone C03156 O-Feruloylgalactarate C03392 Dimethylsulfonioacetate C04075 L-2-Amino-4-chloropent-4-enoate C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04716 25S-5beta-Spirostan-3beta-ol3-O-beta-D-glucoside C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C05203 6-O-Methylnorlaudanosoline C05204 S-7,8,13,14-Tetrahydroprotoberberine C05205 Cytochromecmethionine C05206 HistoneL-arginine C05326 Uridylyl-protein-PII Metabolites in cluster 6: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00139 Oxidizedferredoxin C00147 Adenine C00227 Acetylphosphate C00232 Succinatesemialdehyde C00809 --Camphor C01941 NocardicinA C02236 4-Sulfobenzoate C02526 Biphenyl-2,3-diol C02921 2'-Hydroxyisoflavone C03724 S-5-Hydroxy-2-furoyl-CoA C03741 S-4-Amino-5-oxopentanoate C05417 5,6beta-Epoxy-5beta-cholestane C05418 Cholesterol-5beta,6beta-epoxide C05466 Glycochenodeoxycholate C05467 3alpha,7alpha,12alpha-Trihydroxy-5beta-24-oxocholestanoyl-CoA C05468 5beta-Cyprinolsulfate C05469 17alpha,21-Dihydroxy-5beta-pregnane-3,11,20-trione C05470 Urocortisone C05471 11beta,17alpha,21-Trihydroxy-5beta-pregnane-3,20-dione C05472 Urocortisol C05473 11beta,21-Dihydroxy-3,20-oxo-5beta-pregnan-18-al C05474 3alpha,11beta,21-Trihydroxy-20-oxo-5beta-pregnan-18-al C05475 11beta,21-Dihydroxy-5beta-pregnane-3,20-dione C05476 Tetrahydrocorticosterone C05705 Selenocysteineselenate C06595 gamma-Hexachlorocyclohexane C06596 gamma-Pentachlorocyclohexene C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06618 dTDP-3-oxo-4,6-dideoxy-alpha-D-glucose C06619 dTDP-3-amino-3,4,6-trideoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C09727 --Epicatechin C09762 Liquiritigenin C09769 Asperuloside Metabolites in cluster 7: C00194 Cobamidecoenzyme C00380 Cytosine C00527 Glutaryl-CoA C00630 2-Methylpropanoyl-CoA C00829 Naphthalene C01180 4-Methylthio-2-oxobutanoicacid C01779 Albendazole C01802 Desmosterol C03946 Flavonol3-O-beta-D-glucoside C04234 2-Carboxy-D-arabinitol1-phosphate C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04798 5-Amino-4-chloro-2-2,3-dihydroxyphenyl-32H-pyridazinone C04800 D-Glucuronyl-N-acetyl-1,3-beta-D-galactosaminylproteoglycan C04801 3-Methylcrotonoyl-CoA:carbon-dioxideligaseADP-forming C04802 m7G5'pppRm-RNAmRNAcontaininga2'-O-methylpurinecap C04805 5S-HETE C04806 17alpha-N-Acetyl-D-glucosaminyl-estradiol3-D-glucuronoside C04814 4beta-Hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol C04815 5-D-5/6-5-C-Hydroxymethyl-2,6-dihydroxycyclohex-2-en-1-one C04816 Dephospho-hydroxymethylglutaryl-CoAreductaseNADPHkinase C04819 beta-D-Galactosyl-beta-1,4-N-acetyl-D-glucosaminylglycopeptide C06673 4-Carboxy-4'-sulfoazobenzene C06718 S-Formylmycothiol C06719 Dihydrophloroglucinol C06734 14'-apo-beta-Carotenal C06735 Aminoacetaldehyde C06736 E-11-Tetradecenoyl-CoA C06737 Z-11-Tetradecenoyl-CoA C06738 cis-p-Coumarate C06739 4'-O-beta-D-Glucosyl-cis-p-coumarate C06740 Glucosyl-limonin C06748 Isopropylamine C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C06751 Prenyl-L-cysteine Metabolites in cluster 8: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00208 Maltose C00307 CDP-choline C00314 Pyridoxine C00406 Feruloyl-CoA C02636 3-Dehydrocarnitine C02801 4-Aminobutanoyl-CoA C04293 5,7,4'-Trihydroxy-3'-methoxyflavone C04294 5-2-Hydroxyethyl-4-methylthiazole C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05114 Mucopolysaccharide C05849 VitaminKepoxide C05949 12-Keto-leukotrieneB4 C06146 3-Butyn-1-ol C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine Metabolites in cluster 9: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00332 Acetoacetyl-CoA C00688 dTDP-4-dehydro-6-deoxy-L-mannose C01745 Pinosylvin C01753 Sitosterol C04749 Hydroxymethylglutaryl-CoAreductaseNADPHkinase C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C05100 3-Ureidoisobutyrate Metabolites in cluster 10: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00764 D-Sorbose C01746 Piperidine C05450 3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA C05451 7alpha-Hydroxy-5beta-cholestan-3-one C05452 3alpha,7alpha-Dihydroxy-5beta-cholestane C06157 S-Glutaryldihydrolipoamide C06159 2-Dehydro-3-deoxy-D-fuconate C06160 S-Norcoclaurine C06163 S-cis-N-methylstylopine C06171 7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-5_-morphinan-6-one C06177 Retronecine C06178 1-Methylpyrrolinium C06179 Hygrine C06181 Piperideine C06182 Pelletierine Metabolites in cluster 11: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O Metabolites in cluster 12: C00001 H2O C00198 D-Glucono-1,5-lactone C00291 Nickel C00788 L-Adrenaline C05772 Precorrin3A C05786 3Z-Phycocyanobilin C05813 2-Octaprenyl-6-methoxy-1,4-benzoquinone C05820 L-Seryladenylate C05888 Undecaprenyl-diphospho-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C05889 Undecaprenyl-diphospho-N-acetylmuramoyl-N-acetylglucosamine-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C05899 Undecaprenyl-diphospho-N-acetylmuramoyl-N-acetylglucosamine-L-alanyl-D-glutaminyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine C06331 2-Methylquinoline-3,4-diol C07293 Glutaredoxindisulfide C09321 2'-Hydroxychalcone C09813 2-Ketocyclohexane-1-carboxyl-CoA Metabolites in cluster 13: C00464(n+1) C01412 Butanal C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C05396 Lactose6-phosphate C05400 Epimelibiose C05770 CoproporphyrinIII C05771 1-Aminopropan-2-ol C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C06520 S-Norreticuline C07208 m-Xylene C11432 1-Phenanthrol C11434 2-C-Methyl-D-erythritol4-phosphate C11435 4-Cytidine5'-diphospho-2-C-methyl-D-erythritol C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11437 1-Deoxy-D-xylulose5-phosphate Metabolites in cluster 14: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C00001 H2O C05945 L-Argininephosphate C05953 ProstaglandinA2 C05954 ProstaglandinB2 Metabolites in cluster 15: C00001 H2O C00001 H2O C00001 H2O C00001 H2O C02728 N6-Methyl-L-lysine C03001 N-Benzoyl-D-arginine C05802 2-Hexaprenyl-6-methoxyphenol C05805 2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol C06059 Cyclicamidines C06066 4,5-Dihydro-5,5-dimethyl-4-3-oxobutylfuran-23H-onehexanoate C06074 Myrcene datasetS2/semiStrict_no_o2/0000755000175000017500000000000010747436025015524 5ustar oliveroliverdatasetS2/semiStrict_no_o2/reaction_list.txt0000644000175000017500000011345710747436025021137 0ustar oliveroliverR00002 R00004 R00005 R00006 R00008 R00009 R00010 R00011 R00012 R00013 R00014 R00015 R00016 R00017 R00018 R00019 R00021 R00022 R00023 R00024 R00025 R00026 R00027 R00028 R00029 R00031 R00032 R00033 R00034 R00035 R00036 R00038 R00039 R00040 R00042 R00043 R00044 R00045 R00047 R00048 R00049 R00053 R00054 R00055 R00058 R00059 R00060 R00061 R00062 R00063 R00064 R00066 R00067 R00068 R00069 R00070 R00072 R00073 R00074 R00075 R00076 R00077 R00078 R00080 R00081 R00082 R00083 R00084 R00085 R00086 R00087 R00088 R00089 R00090 R00091 R00092 R00093 R00094 R00095 R00097 R00099 R00100 R00101 R00102 R00103 R00104 R00105 R00106 R00107 R00108 R00109 R00111 R00112 R00113 R00114 R00115 R00116 R00118 R00119 R00120 R00121 R00122 R00123 R00124 R00125 R00126 R00127 R00128 R00129 R00130 R00131 R00132 R00134 R00136 R00137 R00138 R00139 R00140 R00143 R00148 R00149 R00150 R00153 R00155 R00156 R00157 R00158 R00159 R00160 R00161 R00173 R00174 R00175 R00177 R00178 R00179 R00180 R00181 R00182 R00183 R00184 R00185 R00186 R00187 R00188 R00189 R00190 R00191 R00192 R00193 R00194 R00195 R00196 R00197 R00198 R00199 R00200 R00203 R00205 R00206 R00207 R00208 R00209 R00210 R00211 R00212 R00213 R00214 R00215 R00216 R00217 R00218 R00219 R00220 R00221 R00223 R00224 R00226 R00227 R00228 R00229 R00230 R00233 R00235 R00236 R00237 R00238 R00239 R00240 R00241 R00243 R00245 R00248 R00250 R00251 R00253 R00254 R00256 R00257 R00258 R00259 R00260 R00261 R00262 R00264 R00265 R00267 R00268 R00269 R00270 R00271 R00272 R00273 R00274 R00275 R00276 R00277 R00278 R00279 R00280 R00281 R00282 R00283 R00284 R00286 R00287 R00289 R00291 R00293 R00294 R00295 R00296 R00297 R00298 R00299 R00300 R00301 R00302 R00303 R00304 R00305 R00306 R00307 R00310 R00311 R00312 R00313 R00314 R00315 R00316 R00317 R00318 R00319 R00320 R00321 R00322 R00324 R00325 R00326 R00327 R00328 R00330 R00332 R00335 R00336 R00337 R00338 R00339 R00340 R00341 R00342 R00343 R00344 R00345 R00346 R00347 R00348 R00350 R00351 R00352 R00353 R00354 R00355 R00356 R00357 R00359 R00360 R00361 R00362 R00363 R00364 R00365 R00366 R00367 R00368 R00369 R00370 R00371 R00372 R00373 R00381 R00382 R00396 R00397 R00398 R00399 R00400 R00401 R00402 R00405 R00406 R00407 R00408 R00409 R00410 R00411 R00412 R00414 R00415 R00416 R00418 R00420 R00421 R00422 R00423 R00424 R00425 R00426 R00428 R00429 R00430 R00431 R00432 R00434 R00445 R00446 R00447 R00448 R00449 R00451 R00452 R00453 R00454 R00457 R00458 R00460 R00461 R00462 R00463 R00465 R00466 R00468 R00469 R00470 R00471 R00472 R00473 R00474 R00475 R00476 R00477 R00478 R00479 R00480 R00481 R00482 R00483 R00484 R00485 R00486 R00487 R00488 R00489 R00490 R00491 R00494 R00497 R00499 R00500 R00501 R00502 R00503 R00504 R00505 R00507 R00508 R00509 R00510 R00511 R00512 R00513 R00514 R00515 R00516 R00517 R00518 R00519 R00521 R00522 R00524 R00525 R00526 R00527 R00528 R00529 R00530 R00531 R00532 R00533 R00534 R00535 R00536 R00537 R00548 R00549 R00550 R00551 R00552 R00554 R00555 R00556 R00557 R00558 R00559 R00562 R00563 R00565 R00566 R00567 R00568 R00569 R00570 R00571 R00572 R00573 R00574 R00575 R00576 R00578 R00579 R00580 R00581 R00582 R00584 R00585 R00586 R00588 R00589 R00590 R00602 R00603 R00604 R00605 R00606 R00608 R00609 R00610 R00611 R00612 R00614 R00615 R00616 R00617 R00618 R00619 R00621 R00622 R00640 R00642 R00643 R00644 R00645 R00646 R00647 R00648 R00649 R00650 R00651 R00652 R00653 R00654 R00655 R00656 R00657 R00658 R00659 R00660 R00661 R00662 R00664 R00665 R00666 R00667 R00668 R00669 R00670 R00671 R00672 R00673 R00674 R00675 R00676 R00677 R00678 R00679 R00681 R00682 R00683 R00684 R00685 R00686 R00687 R00688 R00689 R00690 R00691 R00692 R00693 R00694 R00695 R00697 R00699 R00700 R00702 R00703 R00704 R00705 R00706 R00707 R00708 R00709 R00710 R00711 R00713 R00714 R00715 R00716 R00717 R00718 R00719 R00720 R00722 R00723 R00724 R00725 R00726 R00727 R00728 R00729 R00730 R00731 R00732 R00733 R00734 R00735 R00736 R00737 R00739 R00740 R00742 R00743 R00744 R00746 R00747 R00748 R00749 R00750 R00751 R00753 R00754 R00755 R00756 R00758 R00760 R00761 R00762 R00763 R00764 R00765 R00766 R00767 R00768 R00769 R00770 R00771 R00772 R00774 R00775 R00776 R00777 R00778 R00781 R00782 R00783 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R07487 R07488 R07489 R07491 R07492 R07493 R07494 R07495 R07497 R07498 R07499 R07500 R07501 R07502 R07503 R07504 R07505 R07506 R07507 R07510 R07511 R07512 R07513 R07514 R07515 R07516 R07517 R07518 R07519 R07520 R07521 R07522 R07523 R07524 R07525 R07526 R07527 R07528 R07529 R07532 R07534 R07535 R07536 R07537 R07538 R07539 R07540 R07541 R07542 R07543 R07551 R07560 R07574 R07576 R07577 R07582 R07583 R07584 R07597 R07598 R07599 R07601 R07603 R07605 R07612 R07613 R07627 R07629 R07630 R07631 R07632 R07633 R07634 R07636 R07638 R07640 R07641 R07643 R07644 R07645 R07646 R07647 R07648 R07649 R07650 R07651 R07653 R07657 R07658 R07659 R07660 R07661 R07662 R07663 R07664 R07665 R07666 R07667 R07668 R07669 R07670 R07672 R07673 R07674 R07675 R07676 R07677 R07678 R07679 R07680 R07682 R07683 R07684 R07686 R07687 R07688 R07689 R07691 R07692 R07698 R07699 R07700 R07701 R07702 R07703 R07704 R07705 R07706 R07707 R07708 R07709 R07710 R07711 R07712 R07713 R07714 R07715 R07716 R07718 R07719 R07720 R07721 R07723 R07724 R07725 R07727 R07728 R07729 R07730 R07731 R07734 R07736 R07737 R07738 R07739 R07740 R07741 R07745 R07746 R07747 R07748 R07751 R07752 R07753 R07754 R07757 R07758 R07759 R07760 R07761 R07770 R07772 R07773 R07774 R07775 R07776 R07777 R07778 R07779 R07780 R07781 R07782 R07793 R07794 R07795 R07796 R07797 R07798 R07799 R07800 R07801 R07802 R07804 R07827 R07828 R07829 R07830 R07831 R07832 R07833 R07835 R07836 R07837 R07839 R07840 R07848 R07849 R07854 R07855 R07856 R07857 R07858 R07861 R07863 R07864 R07865 R07866 R07867 R07868 R07869 R07870 R07871 R07872 R07873 R07874 R07875 R07876 R07877 R07878 R07879 R07880 R07881 R07882 R07883 R07884 R07885 R07886 R07887 R07888 R07889 R07890 R07891 R07892 R07893 R07894 R07895 R07896 R07897 R07898 R07899 R07902 R07903 R07910 R07911 R07912 R07913 R07914 R07917 R07918 R07919 R07920 R07921 R07922 R07923 R07926 R07927 R07928 R07929 R07930 R07931 R07932 R07933 R07934 R07935 R07936 R07937 R07938 R07939 R07942 R07944 R07946 R07949 R07950 R07951 R07952 R07953 R07954 R07955 R07956 R07957 R07958 R07959 R07960 R07961 R07962 R07963 R07964 R07965 R07966 R07967 R07968 R07969 R07970 R07971 R07972 R07973 R07974 R07975 R07976 R07977 R07978 R07979 R07980 R07981 R07982 R07983 R07984 R07985 R07986 R07987 R07988 R07989 R07990 R07991 R07992 R07993 R07995 R07996 R07997 R07998 R07999 R08000 R08001 R08002 R08003 R08005 R08008 R08009 R08010 R08013 R08014 R08015 R08016 R08017 R08018 R08019 R08021 R08022 R08024 R08032 R08036 R08042 R08043 R08044 R08045 R08046 R08047 R08048 R08050 datasetS2/semiStrict_no_o2/consensus_scopes.txt0000644000175000017500000070662410747436025021700 0ustar oliveroliverConsensus scope of cluster 1 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00088 Nitrite C00090 Catechol C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00122 Fumarate C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00217 D-Glutamate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00242 Guanine C00244 Nitrate C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00262 Hypoxanthine C00266 Glycolaldehyde C00282 Hydrogen C00288 HCO3- C00292 Aniline C00295 Orotate C00311 Isocitrate C00315 Spermidine C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00441 L-Aspartate4-semialdehyde C00463 Indole C00472 p-Benzoquinone C00483 Tyramine C00488 Formamide C00490 Itaconate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00612 N1-Acetylspermidine C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00697 Nitrogen C00704 O2.- C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00792 D-Arginine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00986 1,3-Diaminopropane C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01029 N8-Acetylspermidine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01328 HO- C01353 Carbonicacid C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01456 Tropate C01468 4-Cresol C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01667 Bacitracin C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01769 S-Acetoin C01837 Nitroethane C01987 2-Aminophenol C01990 3-Oxalomalate C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02116 2-Nitropropane C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03340 L-2,3-Dihydrodipicolinate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05239 5-Aminoimidazole C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05640 Cinnavalininate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05658 Indoxyl C05665 beta-Aminopropionaldehyde C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06160 S-Norcoclaurine C06195 Imidazolone C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06986 Spirodilactone C07086 Phenylaceticacid C07103 2-Hydroxy-1,4-benzoquinone C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15523 2,6-Dihydroxynicotinate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C15809 Iminoglycine C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 2 C00001 H2O C00007 Oxygen C00011 CO2 C00022 Pyruvate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00084 Acetaldehyde C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00804 Propynoate C00810 R-Acetoin C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02266 D-Xylonolactone C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate Consensus scope of cluster 3 C00001 H2O C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00007 Oxygen C00008 ADP C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00016 FAD C00018 Pyridoxalphosphate C00020 AMP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00047 L-Lysine C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00061 FMN C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00072 Ascorbate C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00088 Nitrite C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00096 GDP-mannose C00099 beta-Alanine C00101 Tetrahydrofolate C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00113 PQQ C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00141 3-Methyl-2-oxobutanoicacid C00143 5,10-Methylenetetrahydrofolate C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00177 Cyanide C00178 Thymine C00179 Agmatine C00180 Benzoate C00181 D-Xylose C00183 L-Valine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00214 Thymidine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00234 10-Formyltetrahydrofolate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00244 Nitrate C00247 L-Sorbose C00250 Pyridoxal C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00255 Riboflavin C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00261 Benzaldehyde C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00268 Dihydrobiopterin C00270 N-Acetylneuraminate C00272 Tetrahydrobiopterin C00273 5-Dehydro-D-fructose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00282 Hydrogen C00286 dGTP C00288 HCO3- C00292 Aniline C00293 Glucose C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00302 Glutamate C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00314 Pyridoxine C00315 Spermidine C00322 2-Oxoadipate C00325 GDP-L-fucose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00363 dTDP C00364 dTMP C00365 dUMP C00366 Urate C00379 Xylitol C00380 Cytosine C00383 Malonate C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00402 D-Aspartate C00408 L-Pipecolate C00415 Dihydrofolate C00417 cis-Aconitate C00423 trans-Cinnamate C00424 S-Lactaldehyde C00425 Dehydroascorbate C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00431 5-Aminopentanoate C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00440 5-Methyltetrahydrofolate C00441 L-Aspartate4-semialdehyde C00445 5,10-Methenyltetrahydrofolate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00449 N6-L-1,3-Dicarboxypropyl-L-lysine C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00459 dTTP C00460 dUTP C00463 Indole C00466 Acetoin C00469 Ethanol C00472 p-Benzoquinone C00474 Ribitol C00475 Cytidine C00476 D-Lyxose C00479 Propanal C00483 Tyramine C00488 Formamide C00489 Glutarate C00490 Itaconate C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00504 Folate C00507 L-Rhamnose C00508 L-Ribulose C00511 Propenoate C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00522 R-Pantoate C00526 Deoxyuridine C00530 p-Benzenediol C00532 L-Arabitol C00533 Nitricoxide C00534 Pyridoxamine C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00547 L-Noradrenaline C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00556 Benzylalcohol C00558 D-Tagaturonate C00559 Deoxyadenosine C00561 Mandelonitrile C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00575 3',5'-CyclicAMP C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00583 Propane-1,2-diol C00587 3-Hydroxybenzoate C00596 2-Hydroxy-2,4-pentadienoate C00597 3-Phosphoglycerate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00612 N1-Acetylspermidine C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00627 Pyridoxinephosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00633 4-Hydroxybenzaldehyde C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00643 5-Hydroxy-L-tryptophan C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00647 Pyridoxaminephosphate C00650 4-Hydroxymandelonitrile C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00664 5-Formiminotetrahydrofolate C00665 beta-D-Fructose2,6-bisphosphate C00666 LL-2,6-Diaminoheptanedioate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00680 meso-2,6-Diaminoheptanedioate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00692 UDP-N-acetylmuramoyl-L-alanyl-D-glutamate C00697 Nitrogen C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00739 D-Lysine C00740 D-Serine C00741 Diacetyl C00755 4-Hydroxy-3-methoxy-benzaldehyde C00763 D-Proline C00770 L-Idonate C00780 3-2-Aminoethyl-1H-indol-5-ol C00785 Urocanate C00788 L-Adrenaline C00789 CDP-ribitol C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00795 D-Tagatose C00800 L-Gulonate C00802 Oxalureate C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00813 Barbiturate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00829 Naphthalene C00842 dTDP-glucose C00844 R-Prunasin C00846 3-Oxoadipate C00847 4-Pyridoxate C00857 Deamino-NAD+ C00860 L-Histidinol C00861 L-Rhamnulose C00864 Pantothenate C00870 4-Nitrophenol C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00906 5,6-Dihydrothymine C00921 Dihydropteroate C00922 2,3-Dimethylmaleate C00931 Porphobilinogen C00935 UDP-L-arabinose C00937 R-Lactaldehyde C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00955 Indole-3-ethanol C00956 L-2-Aminoadipate C00962 beta-D-Galactose C00966 2-Dehydropantoate C00969 3-Hydroxypropanal C00971 4-Pyridoxolactone C00975 Dihydroxyfumarate C00976 GDP-D-mannuronate C00977 L-Tryptophanamide C00986 1,3-Diaminopropane C00988 2-Phosphoglycolate C00989 4-Hydroxybutanoicacid C00990 5-Aminopentanamide C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01007 Reducedriboflavin C01010 Urea-1-carboxylate C01013 3-Hydroxypropanoate C01015 4-Hydroxy-L-proline C01019 6-Deoxy-L-galactose C01020 6-Hydroxynicotinate C01024 Hydroxymethylbilane C01026 N,N-Dimethylglycine C01028 N6-Hydroxy-L-lysine C01029 N8-Acetylspermidine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01050 UDP-N-acetylmuramate C01051 UroporphyrinogenIII C01053 R-4-Dehydropantoate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01062 5-Dehydro-D-gluconate C01068 D-Ribitol5-phosphate C01073 N-Acetyl-beta-alanine C01079 ProtoporphyrinogenIX C01083 alpha,alpha-Trehalose C01088 R-3,3-Dimethylmalate C01089 R-3-Hydroxybutanoate C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01099 L-Fuculose1-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01111 7,8-Dihydroxykynurenate C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01115 L-Galactono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01131 L-Rhamnulose1-phosphate C01133 N-Acetyl-D-glucosaminate C01142 3S-3,6-Diaminohexanoate C01146 2-Hydroxy-3-oxopropanoate C01151 D-Ribose1,5-bisphosphate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01161 3,4-Dihydroxyphenylacetate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01185 NicotinateD-ribonucleotide C01186 3S,5S-3,5-Diaminohexanoate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01198 3-2-Hydroxyphenylpropanoate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01207 3-3,4-Dihydroxyphenyllactate C01212 UDP-N-acetylmuramoyl-L-alanine C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01249 7,8-Dihydro-7,8-dihydroxykynurenate C01250 N-Acetyl-L-glutamate5-semialdehyde C01251 2-Hydroxybutane-1,2,4-tricarboxylate C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01258 1,2-Didehydropiperidine-2-carboxylate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01270 3-Hydroxy-2-methylpyridine-5-carboxylate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01294 1-Guanidino-1-deoxy-scyllo-inositol4-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01328 HO- C01346 dUDP C01352 FADH2 C01353 Carbonicacid C01358 NH4OH C01359 PQQH2 C01367 3'-AMP C01368 3'-UMP C01380 Ethyleneglycol C01384 Maleicacid C01394 Xylose C01401 Alanine C01405 Aspirin C01407 Benzene C01408 Benzoin C01417 Cyanate C01424 Gallate C01438 Methane C01444 Oxamate C01454 Toluate C01455 Toluene C01456 Tropate C01467 3-Cresol C01468 4-Cresol C01475 Allysine C01504 Indanone C01507 L-Iditol C01508 L-Lyxose C01537 Urethane C01542 o-Cresol C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01586 Hippurate C01594 Linamarin C01596 Maleamate C01602 Ornithine C01606 Phthalate C01613 Stachyose C01620 Threonate C01623 UDP-apiose C01659 Acrylamide C01667 Bacitracin C01672 Cadaverine C01674 Chitobiose C01680 D-Fuconate C01682 D-Nopaline C01685 D-Ribonate C01697 Galactitol C01710 Indan-1-ol C01717 4-Hydroxy-2-quinolinecarboxylicacid C01721 L-Fuculose C01727 Lumichrome C01732 Mesaconate C01742 Palatinose C01751 Resorcinol C01762 Xanthosine C01769 S-Acetoin C01772 trans-2-Hydroxycinnamate C01801 Deoxyribose C01818 Hyponitrite C01825 L-Galactose C01837 Nitroethane C01845 Propan-2-ol C01847 ReducedFMN C01855 Taxiphyllin C01877 4-Oxoproline C01879 5-Oxoproline C01888 Aminoacetone C01904 D-Arabitol C01929 L-Histidinal C01934 L-Rhamnonate C01982 R-Amygdalin C01983 R-Mandelate C01984 S-Mandelate C01987 2-Aminophenol C01988 2-Nitrophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C01998 Acrylonitrile C02013 Cellotetraose C02024 D-Mannuronate C02043 Indolelactate C02048 Laminaribiose C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02091 Ureidoglycine C02097 dTDP-galactose C02107 S,S-Tartaricacid C02115 2-Methylserine C02116 2-Nitropropane C02132 Acetylpyruvate C02137 alpha-Oxo-benzeneaceticacid C02161 Isophenoxazine C02167 Maleylpyruvate C02191 Protoporphyrin C02199 UDP-L-rhamnose C02207 beta-Alanopine C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02253 Benzoylagmatine C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02274 Dihydrocoumarin C02280 GDP-L-galactose C02294 Methylguanidine C02295 Methylitaconate C02305 Phosphocreatine C02330 UDP-L-iduronate C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02360 2-Hydroxyadipate C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02376 5-Methylcytosine C02385 AminoacidArg- C02405 Formylphosphate C02427 L-Homocitrulline C02431 L-Rhamnofuranose C02457 Propane-1,3-diol C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02499 2-Hydroxybiphenyl C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02652 5-Dehydroshikimate C02655 6-Acetyl-D-glucose C02657 6-Methylsalicylate C02659 Acetonecyanohydrin C02669 D-Galactono-1,5-lactone C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02721 N-Methyl-L-alanine C02726 N4-Phosphoagmatine C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02780 2,5-Didehydro-D-gluconate C02787 2-Methylpropanamine C02798 3-Phosphonopyruvate C02800 4,5-Dioxopentanoate C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02837 L-Lysine1,6-lactam C02876 Propanoylphosphate C02888 Sorbose1-phosphate C02895 Xylitol5-phosphate C02912 R-Propane-1,2-diol C02916 S-Norlaudanosoline C02917 S-Propane-1,2-diol C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02948 4-Hydroxyhexan-3-one C02964 D-Glucosyl-D-mannose C02977 GDP-6-deoxy-D-talose C02979 Glycerol2-phosphate C02985 L-Fucose1-phosphate C02991 L-Rhamnono-1,4-lactone C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C03003 N-Glucosylnicotinate C03004 N-Hydroxy-L-tyrosine C03012 Naphthalene-1,2-diol C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03034 dTDP-D-galacturonate C03044 R,R-Butane-2,3-diol C03046 S,S-Butane-2,3-diol C03047 1,4-Diguanidinobutane C03056 2,6-Dihydroxypyridine C03057 2-Carboxybenzaldehyde C03063 2-Oxohept-3-enedioate C03064 3-Dehydro-L-threonate C03065 3-Guanidinopropanoate C03067 3-Hydroxybenzaldehyde C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03087 5-Acetamidopentanoate C03088 5-Hydroxymethyluracil C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03107 D-Glucono-1,4-lactone C03117 GDP-6-deoxy-D-mannose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03150 N-Ribosylnicotinamide C03153 N5-Methyl-L-glutamine C03164 Phenanthrene-3,4-diol C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03187 dTDP-6-deoxy-L-talose C03194 R-1-Aminopropan-2-ol C03198 S-4-Hydroxymandelate C03203 1-Hydroxy-2-naphthoate C03204 10-Formyldihydrofolate C03210 2,2'-Iminodipropanoate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03239 6-Amino-2-oxohexanoate C03246 ADPribose2'-phosphate C03248 Acetylenedicarboxylate C03263 CoproporphyrinogenIII C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03273 5-Oxopentanoate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03287 L-Glutamyl5-phosphate C03289 L-xylo-Hexulonolactone C03290 L-threo-3-Phenylserine C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03296 N2-Succinyl-L-arginine C03319 dTDP-6-deoxy-L-mannose C03340 L-2,3-Dihydrodipicolinate C03341 2-Amino-4-oxopentanoicacid C03351 3-Hydroxybenzylalcohol C03360 4-Nitrophenylphosphate C03373 Aminoimidazoleribotide C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03393 4-Phospho-D-erythronate C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03410 N-Glycoloyl-neuraminate C03415 N2-Succinyl-L-ornithine C03440 cis-4-Hydroxy-D-proline C03442 dTDP-L-dihydrostreptose C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03479 5-Formyltetrahydrofolate C03483 Adenosinetetraphosphate C03492 D-4'-Phosphopantothenate C03493 D-4-Hydroxyphenylglycine C03495 Deoxy-5-methylcytidylate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03549 2-Hydroxycinnamate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03590 4-Hydroxyphenylglyoxylate C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03652 2R,3S-2,3-Dimethylmalate C03656 S-5-Amino-3-oxohexanoicacid C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03672 3-4-Hydroxyphenyllactate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03691 CMP-N-glycoloylneuraminate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03710 N-Benzyloxycarbonylglycine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03741 S-4-Amino-5-oxopentanoate C03742 S-4-Hydroxymandelonitrile C03750 2,6-Dioxo-6-phenylhexanoate C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03766 4-Hydroxyphenylacetonitrile C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03790 N-Carboxymethyl-D-alanine C03794 N6-1,2-Dicarboxyethyl-AMP C03817 S-3-Imidazol-5-yllactate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03871 L-2-Amino-6-oxoheptanedioate C03872 L-Serine-phosphoethanolamine C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03964 R-3-4-Hydroxyphenyllactate C03971 1F-alpha-D-Galactosylraffinose C03972 2,3,4,5-Tetrahydrodipicolinate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C03996 5'-O-beta-D-Glucosylpyridoxine C03997 5-Hydroxymethyldeoxycytidylate C04002 But-1-ene-1,2,4-tricarboxylate C04006 1D-myo-Inositol3-phosphate C04020 N2-D-1-Carboxyethyl-L-lysine C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04039 2,3-Dihydroxy-3-methylbutanoate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04053 5-Dehydro-4-deoxy-D-glucuronate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04076 L-2-Aminoadipate6-semialdehyde C04089 UDP-4-dehydro-6-deoxy-D-glucose C04091 cis-1,2-Dihydrobenzene-1,2-diol C04092 delta1-Piperideine-2-carboxylate C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04137 N2-D-1-Carboxyethyl-L-arginine C04138 Nalpha-gamma-L-Glutamylhistamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04187 5-Methyldeoxycytidinediphosphate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04210 N5-L-1-Carboxyethyl-L-ornithine C04211 N6-Indol-3-ylacetyl-L-lysine C04221 trans-1,2-Dihydrobenzene-1,2-diol C04225 Z-But-2-ene-1,2,3-tricarboxylate C04226 6-oxo-1,4,5,6-tetrahydronicotinate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04244 6-Lactoyl-5,6,7,8-tetrahydropterin C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04268 dTDP-4-amino-4,6-dideoxy-D-glucose C04272 R-2,3-Dihydroxy-3-methylbutanoate C04280 1-Guanidino-1-deoxy-scyllo-inositol C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04297 CDP-4-dehydro-3,6-dideoxy-D-glucose C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04314 cis-1,2-Dihydronaphthalene-1,2-diol C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04332 6,7-Dimethyl-8-1-D-ribityllumazine C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04353 Z-4-Hydroxyphenylacetaldehyde-oxime C04359 1-Deoxy-D-altro-heptulose7-phosphate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04437 1-5-Phosphoribosylimidazole-4-acetate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04454 5-Amino-6-5'-phosphoribitylaminouracil C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04462 N-Succinyl-2-L-amino-6-oxoheptanedioate C04468 +-cis-3,4-Dihydrophenanthrene-3,4-diol C04471 4S,5S-4,5-Dihydroxy-2,6-dioxohexanoate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04514 1S,2S-1,2-Dihydronaphthalene-1,2-diol C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04546 R-3-R-3-Hydroxybutanoyloxybutanoate C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04573 UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C04579 Inositol1,2,3,4,5-pentakisphosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04592 Toluene-cis-dihydrodiol C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04634 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04700 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine C04702 UDPMurAcoyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04732 4-1-D-Ribitylamino-5-amino-2,6-dihydroxypyrimidine C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04783 cis-4,5-Dihydroxycyclohexa-16,2-diene-1,2-dicarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04856 6S-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04877 UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate C04882 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05005 Glycolipid C05100 3-Ureidoisobutyrate C05114 Mucopolysaccharide C05130 Imidazole-4-acetaldehyde C05131 1-Ribosylimidazole-4-acetate C05133 4-Imidazolone-5-acetate C05143 Dhurrin C05145 3-Aminoisobutanoate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05161 2,5-Diaminohexanoate C05235 Hydroxyacetone C05239 5-Aminoimidazole C05328 D-2-Amino-hexano-6-lactam C05332 Phenethylamine C05340 beta-Alanyl-L-arginine C05341 beta-Alanyl-L-lysine C05343 R-4-Hydroxymandelate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05379 Oxalosuccinate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05385 D-Glucuronate1-phosphate C05394 3-Keto-beta-D-galactose C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05403 3-Ketolactose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05411 L-Xylonate C05412 L-Lyxonate C05422 L-Dehydroascorbate C05512 Deoxyinosine C05513 Urate-3-ribonucleoside C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05533 Oxaloglutarate C05539 N-Acetyl-L-2-amino-6-oxopimelate C05548 6-Acetamido-2-oxohexanoate C05560 L-2-Aminoadipateadenylate C05565 Hydantoin-5-propionate C05568 Imidazolelactate C05569 5'-Phospho-D-1-ribulosylformimine C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05576 3,4-Dihydroxyphenylethyleneglycol C05577 3,4-Dihydroxymandelaldehyde C05580 3,4-Dihydroxymandelate C05585 Gentisatealdehyde C05593 3-Hydroxyphenylacetate C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05607 Phenyllactate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05629 Phenylpropanoate C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05638 5-Hydroxykynurenamine C05639 4,6-Dihydroxyquinoline C05640 Cinnavalininate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05646 5-Hydroxyindolepyruvate C05647 Formyl-5-hydroxykynurenamine C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05654 5-2'-Formylethyl-4,6-dihydroxypicolinate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05656 5-3'-Carboxy-3'-oxopropyl-4,6-dihydroxypicolinate C05657 6-Hydroxyindolelactate C05658 Indoxyl C05662 Homoisocitrate C05665 beta-Aminopropionaldehyde C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05731 3-Ketosucrose C05765 L-Glutamyl1-phosphate C05766 UroporphyrinogenI C05768 CoproporphyrinogenI C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05820 L-Seryladenylate C05822 3'-CMP C05825 2-Amino-5-oxohexanoate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05838 cis-2-Hydroxycinnamate C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05840 Iminoaspartate C05841 NicotinateD-ribonucleoside C05851 Coumarin C05852 2-Hydroxyphenylacetate C05853 Phenylethylalcohol C05854 4-Carboxy-2-oxo-4-pentanoate C05892 UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05928 10-FormyltetrahydrofolylL-glutamate C05931 N-Succinyl-L-glutamate C05932 N-Succinyl-L-glutamate5-semialdehyde C05933 N-omega-Hydroxyarginine C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05938 L-4-Hydroxyglutamatesemialdehyde C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05979 Propane-1-ol C05983 Propinoladenylate C05984 2-Hydroxybutanoicacid C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C05993 Acetyladenylate C05999 Lactaldehyde C06010 S-2-Acetolactate C06016 Pentosans C06017 dTDP-D-glucuronate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06044 4-Hydroxyphenylethanol C06046 Salidroside C06047 Stizolobate C06048 Stizolobinate C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal C06054 2-Oxo-3-hydroxy-4-phosphobutanoate C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol C06059 Cyclicamidines C06114 gamma-Glutamyl-beta-aminopropiononitrile C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06156 alpha-D-Glucosamine1-phosphate C06159 2-Dehydro-3-deoxy-D-fuconate C06160 S-Norcoclaurine C06180 Anabasine C06181 Piperideine C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06202 Salicylaldehyde C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06205 1,2-Dihydronaphthalene-1,2-diol C06206 Benzoylphosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06240 UDP-N-acetyl-D-mannosaminouronate C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06311 Galactitol1-phosphate C06312 L-Tagatose6-phosphate C06313 Biopterin C06316 D-erythro-Ascorbate C06317 4-Hydroxy-3-methoxy-benzenemethanol C06318 3S,4R-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate C06321 1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylicacid C06330 Quinoline-3,4-diol C06337 Terephthalate C06343 Quinolin-4-ol C06358 Methylcinnamate C06359 Ethylcinnamate C06360 Propylcinnamate C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06430 D-Galacturonolactone C06432 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanine C06433 5'-Benzoylphosphoadenosine C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06547 Ethylene C06548 Ethyleneoxide C06554 Cyanuricacid C06555 Biuret C06588 Biphenyl C06589 cis-2,3-Dihydro-2,3-dihydroxybiphenyl C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06672 Vanillate C06680 4-Hydroxyphthalate C06701 Phosphonate C06711 Fluoren-9-ol C06712 Fluoren-9-one C06720 1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate C06727 cis-1,2-Dihydro-3-ethylcatechol C06728 3-Ethylcatechol C06729 cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate C06730 4-Methylcatechol C06731 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate C06732 alpha,beta-Didehydrotryptophan C06735 Aminoacetaldehyde C06746 N-Acetylphenylethylamine C06756 p-Xylene C06757 4-Methylbenzylalcohol C06758 p-Tolualdehyde C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06876 Nitrosobenzene C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C06986 Spirodilactone C07024 3'-Keto-3'-deoxy-ATP C07025 3'-Keto-3'-deoxy-AMP C07083 Styrene C07084 Styrenecis-glycol C07085 3-Vinylcatechol C07086 Phenylaceticacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07111 Ethylbenzene C07112 1-Phenylethanol C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07130 Theophylline C07208 m-Xylene C07209 3-Methylbenzaldehyde C07211 m-Methylbenzoate C07212 o-Xylene C07213 2-Methylbenzylalcohol C07214 2-Methylbenzaldehyde C07215 o-Toluate C07216 3-Methylbenzylalcohol C07272 Maleimide C07277 dTDP-D-fucose C07301 R-Mandelamide C07305 ProductsofATPbreakdown C07335 2-Amino-3-oxo-4-phosphonooxybutyrate C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07480 Theobromine C07481 Caffeine C07715 Fluorene C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07719 2-Formyl-1-indanone C07720 3-Hydroxy-1-indanone C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07726 1-Formyl-2-indanone C07729 Dibenzofuran C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07732 Dibenzo-p-dioxin C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08060 Carbazole C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08481 Indican C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C09332 Tetrahydrofolyl-Glu2 C09814 Benzonitrile C09815 Benzamide C09816 Benzylsuccinate C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C10700 4'-Hydroxyacetophenone C10906 D-Fructose C11038 2'-Deoxy-5-hydroxymethylcytidine-5'-diphosphate C11039 2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate C11130 3-Hydroxyindolin-2-one C11174 1-Diphosinositolpentakisphosphate C11348 S-1-Phenylethanol C11354 2-Hydroxy-cis-hex-2,4-dienoate C11355 4-Amino-4-deoxychorismate C11422 Phenanthracene C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C11427 1-Hydroxy-2-naphthaldehyde C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol C11434 2-C-Methyl-D-erythritol4-phosphate C11435 4-Cytidine5'-diphospho-2-C-methyl-D-erythritol C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11437 1-Deoxy-D-xylulose5-phosphate C11453 2-C-Methyl-D-erythritol2,4-cyclodiphosphate C11457 3-3-Hydroxy-phenyl-propanoicacid C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11588 cis-3-Carboxy-ethyl-3,5-cyclo-hexadiene-1,2-diol C11631 9-Riburonosylhypoxanthine C11638 3-Amino-2-oxopropylphosphate C11713 beta-Naphthol C11714 alpha-Naphthol C11821 5-Hydroxyisourate C11822 2-Aminomalonatesemialdehyde C11824 Cyclicamide C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11920 dTDP-L-olivose C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose C11925 dTDP-3-amino-3,6-dideoxy-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose C12210 UDP-3-ketoglucose C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12312 Indolin-2-one C12318 dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose C12323 L-4-Hydroxyphenylglycine C12455 5-Aminopentanal C12621 trans-3-Hydroxycinnamate C12622 cis-3-3-Carboxyethenyl-3,5-cyclohexadiene-1,2-diol C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C12986 N2-Acetyl-L-aminoadipate C12987 N2-Acetyl-L-aminoadipyl-delta-phosphate C12988 N2-Acetyl-L-aminoadipatesemialdehyde C12989 N2-Acetyl-L-lysine C13624 BisphenolA C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene C13633 2,2-Bis4-hydroxyphenyl-propanoicacid C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13637 4-Ethylphenol C13638 1-4'-Hydroxyphenylethanol C13747 1,7-Dimethylxanthine C13952 UDP-N-acetyl-D-galactosaminuronicacid C14082 1-Methylnaphthalene C14083 cis-1,2-Dihydroxy-1,2-dihydro-8-methylnaphthalene C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14087 3-Methylsalicylaldehyde C14088 3-Methylsalicylate C14089 1-Hydroxymethylnaphthalene C14090 1-Naphthaldehyde C14091 1-Naphthoicacid C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14103 4-Methylsalicylate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14783 1,2-Naphthoquinone C14784 1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15483 D-Galactonolactone C15499 Pentane-2,4-dione C15503 N,N-Dihydroxy-L-tyrosine C15522 4a-Hydroxytetrahydrobiopterin C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15585 myo-Inositolphosphate C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15607 3-Oxo-3-ureidopropanoate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15769 HBOA C15770 DIBOA C15772 DIBOA-glucoside C15809 Iminoglycine C15853 Dehydrospermidine C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15930 L-Galactonate C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16071 Riboflavincyclic-4',5'-phosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16153 UDP-L-Ara4N C16154 UDP-L-Ara4FN C16155 UDP-L-Ara4O C16159 2-Formylglutarate C16186 L-Ascorbate6-phosphate C16215 1,2-Dihydrophthalicacid C16234 o-Nitrobenzoate C16235 o-Hydroxylaminobenzoate C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16352 7-Methylxanthosine C16353 7-Methylxanthine C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16357 3-Methylxanthine C16358 1-Methylxanthine C16359 1-Methyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 4 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00058 Formate C00067 Formaldehyde C00080 H+ C00085 D-Fructose6-phosphate C00089 Sucrose C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00132 Methanol C00137 myo-Inositol C00159 D-Mannose C00184 Glycerone C00185 Cellobiose C00191 D-Glucuronate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00227 Acetylphosphate C00231 D-Xylulose5-phosphate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00447 D-Sedoheptulose1,7-bisphosphate C00514 D-Mannonate C00536 Triphosphate C00546 Methylglyoxal C00577 D-Glyceraldehyde C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00629 2-Dehydro-D-gluconate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00905 D-Fructuronate C00969 3-Hydroxypropanal C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01742 Palatinose C02013 Cellotetraose C02048 Laminaribiose C02336 beta-D-Fructose C02466 Trimetaphosphate C02591 Sucrose6-phosphate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03546 myo-Inositol4-phosphate C03661 1F-beta-D-Fructosylsucrose C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05682 Phosphonoacetate C05999 Lactaldehyde C06019 D-arabino-3-Hexulose6-phosphate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone C07836 D-glycero-D-manno-Heptose7-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15585 myo-Inositolphosphate Consensus scope of cluster 5 C00001 H2O C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00514 D-Mannonate C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Consensus scope of cluster 6 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00022 Pyruvate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00067 Formaldehyde C00074 Phosphoenolpyruvate C00080 H+ C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00121 D-Ribose C00122 Fumarate C00132 Methanol C00137 myo-Inositol C00149 S-Malate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00216 D-Arabinose C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00252 Isomaltose C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00309 D-Ribulose C00311 Isocitrate C00345 6-Phospho-D-gluconate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00447 D-Sedoheptulose1,7-bisphosphate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00514 D-Mannonate C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00552 meso-Tartaricacid C00577 D-Glyceraldehyde C00596 2-Hydroxy-2,4-pentadienoate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00636 D-Mannose1-phosphate C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00711 Malate C00794 D-Sorbitol C00804 Propynoate C00810 R-Acetoin C00817 D-Altronate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00944 3-Dehydroquinate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01108 1,2,3-Trihydroxybenzene C01112 D-Arabinose5-phosphate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02266 D-Xylonolactone C02336 beta-D-Fructose C02341 trans-Aconitate C02351 1,2-Benzoquinone C02466 Trimetaphosphate C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02591 Sucrose6-phosphate C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02753 D-Xylono-1,4-lactone C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03167 Phosphonoacetaldehyde C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03716 Oxaloacetate4-methylester C03736 alpha-D-Ribose5-phosphate C03765 4-Hydroxyphenylacetaldehyde C03785 D-Tagatose1,6-bisphosphate C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03947 Glycerol1,2-cyclicphosphate C03981 2-Hydroxyethylenedicarboxylate C04006 1D-myo-Inositol3-phosphate C04044 3-2,3-Dihydroxyphenylpropanoate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05616 3-O-Methylgallate C05682 Phosphonoacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06187 Arbutin6-phosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06316 D-erythro-Ascorbate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07103 2-Hydroxy-1,4-benzoquinone C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C11437 1-Deoxy-D-xylulose5-phosphate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14899 3-Dehydro-L-gulonate6-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15585 myo-Inositolphosphate C16186 L-Ascorbate6-phosphate Consensus scope of cluster 7 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00704 O2.- C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Consensus scope of cluster 8 C00001 H2O C00080 H+ C00282 Hydrogen C05359 e- C05421 15-cis-Phytoene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15892 Chloroxanthin C15898 Demethylspheroidene C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16276 epsilon-Carotene Consensus scope of cluster 9 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 10 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00022 Pyruvate C00024 Acetyl-CoA C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00083 Malonyl-CoA C00084 Acetaldehyde C00090 Catechol C00091 Succinyl-CoA C00100 Propanoyl-CoA C00109 2-Oxobutanoate C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00313 Oxalyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00383 Malonate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00511 Propenoate C00530 p-Benzenediol C00531 Itaconyl-CoA C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00566 3S-Citryl-CoA C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00798 Formyl-CoA C00804 Propynoate C00810 R-Acetoin C00815 Citramalate C00818 D-Glucarate C00827 Lactoyl-CoA C00846 3-Oxoadipate C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00904 Citramalyl-CoA C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C00989 4-Hydroxybutanoicacid C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01213 R-2-Methyl-3-oxopropanoyl-CoA C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01468 4-Cresol C01548 Acetylene C01572 Digallate C01732 Mesaconate C01757 Triacetate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02170 Methylmalonate C02214 E-Glutaconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02266 D-Xylonolactone C02295 Methylitaconate C02331 Vinylacetyl-CoA C02341 trans-Aconitate C02351 1,2-Benzoquinone C02411 Glutaconyl-1-CoA C02480 cis,cis-Muconate C02488 R-2-Ethylmalate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02557 Methylmalonyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02814 Benzene-1,2,4-triol C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C03058 2-Hydroxyglutaryl-CoA C03223 3,4-Dihydroxyphthalate C03231 3-Methylglutaconyl-CoA C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03344 2-Methylacetoacetyl-CoA C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03561 R-3-Hydroxybutanoyl-CoA C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05116 3-Hydroxybutanoyl-CoA C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05585 Gentisatealdehyde C05668 3-Hydroxypropionyl-CoA C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06002 S-Methylmalonatesemialdehyde C06010 S-2-Acetolactate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06719 Dihydrophloroglucinol C06728 3-Ethylcatechol C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11062 4-Hydroxybutyryl-CoA C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16268 Cyclopropanecarboxyl-CoA C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 11 C00001 H2O C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose Consensus scope of cluster 12 C00001 H2O C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C01312 ProstaglandinI2 C02198 ThromboxaneA2 C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C14717 15-Deoxy-delta-12,14-PGJ2 Consensus scope of cluster 13 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00080 H+ C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00282 Hydrogen C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C00521 --Limonene C00536 Triphosphate C01230 all-trans-Hexaprenyldiphosphate C01390 Prenol C01414 Casbene C01841 Pentalenene C01860 Trichodiene C02004 Aristolochene C02344 --endo-Fenchol C02462 Sabinenehydrate C02466 Trimetaphosphate C02569 Neryldiphosphate C03190 +-Bornyl-diphosphate C03427 Prephytoenediphosphate C03428 Presqualenediphosphate C04216 all-trans-Heptaprenyldiphosphate C04217 all-trans-Pentaprenyldiphosphate C04509 di-trans,poly-cis-Decaprenyldiphosphate C04574 di-trans,poly-cis-Undecaprenyldiphosphate C05359 e- C05413 Phytoene C05414 Phytofluene C05421 15-cis-Phytoene C05430 zeta-Carotene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C06074 Myrcene C06075 Terpinolene C06076 Comphene C06077 Pinene C06086 Pimaradiene C06089 ent-Copalyldiphosphate C06090 ent-Kaurene C06099 +-Limonene C06111 Nerolidyldiphosphate C06307 --beta-Pinene C06308 --alpha-Pinene C06394 +-delta-Cadinene C08586 delta-Carotene C11356 trans,trans,cis-Geranylgeranyldiphosphate C11388 --Linalool C11389 +-Linalool C11877 +-Sandaracopimaradiene C11878 --Abietadiene C11879 Levopimaradiene C11880 Neoabietadiene C11881 Palustradiene C11894 Taxa-45,1112-diene C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate C12142 Vetispiradiene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15892 Chloroxanthin C15898 Demethylspheroidene C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16028 Amorpha-4,11-diene C16141 +-GermacreneA C16142 --GermacreneD C16143 1E,4S,5E,7R-Germacra-110,5-dien-11-ol C16269 epi-Isozizaene C16276 epsilon-Carotene Consensus scope of cluster 14 C00001 H2O C00011 CO2 C00047 L-Lysine C00666 LL-2,6-Diaminoheptanedioate C00680 meso-2,6-Diaminoheptanedioate C00739 D-Lysine C01142 3S-3,6-Diaminohexanoate C01186 3S,5S-3,5-Diaminohexanoate C01353 Carbonicacid C01672 Cadaverine C02837 L-Lysine1,6-lactam C05161 2,5-Diaminohexanoate C05328 D-2-Amino-hexano-6-lactam Consensus scope of cluster 15 C00001 H2O C00002 ATP C00003 NAD+ C00004 NADH C00005 NADPH C00006 NADP+ C00007 Oxygen C00008 ADP C00009 Orthophosphate C00010 CoA C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00016 FAD C00018 Pyridoxalphosphate C00019 S-Adenosyl-L-methionine C00020 AMP C00021 S-Adenosyl-L-homocysteine C00022 Pyruvate C00024 Acetyl-CoA C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00047 L-Lysine C00048 Glyoxylate C00049 L-Aspartate C00051 Glutathione C00052 UDP-D-galactose C00053 3'-Phosphoadenylylsulfate C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00059 Sulfate C00061 FMN C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00072 Ascorbate C00073 L-Methionine C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00083 Malonyl-CoA C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00087 Sulfur C00088 Nitrite C00089 Sucrose C00090 Catechol C00091 Succinyl-CoA C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00094 Sulfite C00095 D-Fructose C00096 GDP-mannose C00097 L-Cysteine C00099 beta-Alanine C00100 Propanoyl-CoA C00101 Tetrahydrofolate C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00113 PQQ C00114 Choline C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00120 Biotin C00121 D-Ribose C00122 Fumarate C00123 L-Leucine C00124 D-Galactose C00127 Glutathionedisulfide C00128 CMP-N-acetylneuraminate C00129 Isopentenyldiphosphate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00136 Butanoyl-CoA C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00141 3-Methyl-2-oxobutanoicacid C00143 5,10-Methylenetetrahydrofolate C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00154 Palmitoyl-CoA C00155 L-Homocysteine C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00170 5'-Methylthioadenosine C00177 Cyanide C00178 Thymine C00179 Agmatine C00180 Benzoate C00181 D-Xylose C00183 L-Valine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00214 Thymidine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00223 p-Coumaroyl-CoA C00224 Adenylylsulfate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00233 4-Methyl-2-oxopentanoate C00234 10-Formyltetrahydrofolate C00235 Dimethylallyldiphosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00244 Nitrate C00245 Taurine C00246 Butanoicacid C00247 L-Sorbose C00249 Hexadecanoicacid C00250 Pyridoxal C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00255 Riboflavin C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00261 Benzaldehyde C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00268 Dihydrobiopterin C00270 N-Acetylneuraminate C00272 Tetrahydrobiopterin C00273 5-Dehydro-D-fructose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00282 Hydrogen C00283 Hydrogensulfide C00286 dGTP C00288 HCO3- C00292 Aniline C00293 Glucose C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00302 Glutamate C00307 CDP-choline C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00313 Oxalyl-CoA C00314 Pyridoxine C00315 Spermidine C00319 Sphingosine C00320 Thiosulfate C00322 2-Oxoadipate C00323 Caffeoyl-CoA C00325 GDP-L-fucose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00332 Acetoacetyl-CoA C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00341 Geranyldiphosphate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00349 2-Methyl-3-oxopropanoate C00352 D-Glucosamine6-phosphate C00353 Geranylgeranyldiphosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00363 dTDP C00364 dTMP C00365 dUMP C00366 Urate C00379 Xylitol C00380 Cytosine C00383 Malonate C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00389 Quercetin C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00400 --Menthol C00402 D-Aspartate C00406 Feruloyl-CoA C00407 L-Isoleucine C00408 L-Pipecolate C00409 Methanethiol C00411 Sinapoyl-CoA C00412 Stearoyl-CoA C00414 Cyclohexanone C00415 Dihydrofolate C00417 cis-Aconitate C00418 R-Mevalonate C00423 trans-Cinnamate C00424 S-Lactaldehyde C00425 Dehydroascorbate C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00431 5-Aminopentanoate C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00440 5-Methyltetrahydrofolate C00441 L-Aspartate4-semialdehyde C00445 5,10-Methenyltetrahydrofolate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00448 trans,trans-Farnesyldiphosphate C00449 N6-L-1,3-Dicarboxypropyl-L-lysine C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00459 dTTP C00460 dUTP C00463 Indole C00466 Acetoin C00469 Ethanol C00472 p-Benzoquinone C00474 Ribitol C00475 Cytidine C00476 D-Lyxose C00479 Propanal C00482 Sinapate C00483 Tyramine C00488 Formamide C00489 Glutarate C00490 Itaconate C00491 L-Cystine C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00504 Folate C00506 L-Cysteate C00507 L-Rhamnose C00508 L-Ribulose C00509 Naringenin C00511 Propenoate C00512 S-BenzoatecoenzymeA C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00517 Hexadecanal C00519 Hypotaurine C00521 --Limonene C00522 R-Pantoate C00526 Deoxyuridine C00527 Glutaryl-CoA C00530 p-Benzenediol C00531 Itaconyl-CoA C00532 L-Arabitol C00533 Nitricoxide C00534 Pyridoxamine C00536 Triphosphate C00540 Cinnamoyl-CoA C00542 Cystathionine C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00547 L-Noradrenaline C00548 Phenylacetate C00552 meso-Tartaricacid C00553 +-Neomenthol C00555 4-Aminobutanal C00556 Benzylalcohol C00558 D-Tagaturonate C00559 Deoxyadenosine C00561 Mandelonitrile C00566 3S-Citryl-CoA C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00571 Cyclohexylamine C00575 3',5'-CyclicAMP C00576 Betainealdehyde C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00582 Phenylacetyl-CoA C00583 Propane-1,2-diol C00587 3-Hydroxybenzoate C00588 Cholinephosphate C00590 Coniferylalcohol C00593 Sulfoacetaldehyde C00596 2-Hydroxy-2,4-pentadienoate C00597 3-Phosphoglycerate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00611 N-Acetyllactosamine C00612 N1-Acetylspermidine C00616 Quercetin3-sulfate C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00627 Pyridoxinephosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00630 2-Methylpropanoyl-CoA C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00633 4-Hydroxybenzaldehyde C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00643 5-Hydroxy-L-tryptophan C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00647 Pyridoxaminephosphate C00650 4-Hydroxymandelonitrile C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00664 5-Formiminotetrahydrofolate C00665 beta-D-Fructose2,6-bisphosphate C00666 LL-2,6-Diaminoheptanedioate C00668 alpha-D-Glucose6-phosphate C00669 gamma-L-Glutamyl-L-cysteine C00670 sn-glycero-3-Phosphocholine C00671 S-3-Methyl-2-oxopentanoicacid C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00680 meso-2,6-Diaminoheptanedioate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00692 UDP-N-acetylmuramoyl-L-alanyl-D-glutamate C00697 Nitrogen C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00719 Betaine C00736 Cysteine C00739 D-Lysine C00740 D-Serine C00741 Diacetyl C00745 Nicotine C00750 Spermine C00751 Squalene C00755 4-Hydroxy-3-methoxy-benzaldehyde C00757 Berberine C00761 Coniferin C00763 D-Proline C00770 L-Idonate C00772 Mevaldate C00780 3-2-Aminoethyl-1H-indol-5-ol C00785 Urocanate C00786 --Vestitone C00788 L-Adrenaline C00789 CDP-ribitol C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00794 D-Sorbitol C00795 D-Tagatose C00798 Formyl-CoA C00800 L-Gulonate C00802 Oxalureate C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00813 Barbiturate C00814 BiochaninA C00815 Citramalate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00823 1-Hexadecanol C00826 L-Arogenate C00827 Lactoyl-CoA C00829 Naphthalene C00831 Pantetheine C00836 Sphinganine C00842 dTDP-glucose C00843 --Menthone C00844 R-Prunasin C00846 3-Oxoadipate C00847 4-Pyridoxate C00852 Chlorogenate C00854 Cyclohexanol C00855 D-Methionine C00857 Deamino-NAD+ C00858 Formononetin C00860 L-Histidinol C00861 L-Rhamnulose C00864 Pantothenate C00870 4-Nitrophenol C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00882 Dephospho-CoA C00884 Homocarnosine C00885 Isochorismate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00903 Cinnamaldehyde C00904 Citramalyl-CoA C00905 D-Fructuronate C00906 5,6-Dihydrothymine C00916 CephalosporinC C00919 Cholinesulfate C00920 CoA-glutathione C00921 Dihydropteroate C00922 2,3-Dimethylmaleate C00928 Mercaptoethanol C00931 Porphobilinogen C00933 Sinapoylcholine C00935 UDP-L-arabinose C00937 R-Lactaldehyde C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00955 Indole-3-ethanol C00956 L-2-Aminoadipate C00957 Mercaptopyruvate C00962 beta-D-Galactose C00964 --trans-Carveol C00966 2-Dehydropantoate C00969 3-Hydroxypropanal C00971 4-Pyridoxolactone C00974 Dihydrokaempferol C00975 Dihydroxyfumarate C00976 GDP-D-mannuronate C00977 L-Tryptophanamide C00978 N-Acetylserotonin C00979 O-Acetyl-L-serine C00986 1,3-Diaminopropane C00988 2-Phosphoglycolate C00989 4-Hydroxybutanoicacid C00990 5-Aminopentanamide C00993 D-Alanyl-D-alanine C01004 N-Methylnicotinate C01005 O-Phospho-L-serine C01007 Reducedriboflavin C01010 Urea-1-carboxylate C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01015 4-Hydroxy-L-proline C01019 6-Deoxy-L-galactose C01020 6-Hydroxynicotinate C01024 Hydroxymethylbilane C01026 N,N-Dimethylglycine C01028 N6-Hydroxy-L-lysine C01029 N8-Acetylspermidine C01031 S-Formylglutathione C01033 2-Methylbutanoyl-CoA C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01037 7,8-Diaminononanoate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01050 UDP-N-acetylmuramate C01051 UroporphyrinogenIII C01053 R-4-Dehydropantoate C01054 S-2,3-Epoxysqualene C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01062 5-Dehydro-D-gluconate C01063 6-Carboxyhexanoyl-CoA C01068 D-Ribitol5-phosphate C01073 N-Acetyl-beta-alanine C01075 N-Sulfo-D-glucosamine C01077 O-Acetyl-L-homoserine C01079 ProtoporphyrinogenIX C01083 alpha,alpha-Trehalose C01088 R-3,3-Dimethylmalate C01089 R-3-Hydroxybutanoate C01092 8-Amino-7-oxononanoate C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01099 L-Fuculose1-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01107 R-5-Phosphomevalonate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01111 7,8-Dihydroxykynurenate C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01115 L-Galactono-1,4-lactone C01118 O-Succinyl-L-homoserine C01120 Sphinganine1-phosphate C01123 --trans-Isopiperitenol C01127 4-Hydroxy-2-oxoglutarate C01131 L-Rhamnulose1-phosphate C01133 N-Acetyl-D-glucosaminate C01134 Pantetheine4'-phosphate C01137 S-Adenosylmethioninamine C01142 3S-3,6-Diaminohexanoate C01143 R-5-Diphosphomevalonate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01147 2-Hydroxycyclohexan-1-one C01151 D-Ribose1,5-bisphosphate C01152 Npi-Methyl-L-histidine C01155 Quercetin3,3'-bissulfate C01156 Quercetin3,4'-bissulfate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01161 3,4-Dihydroxyphenylacetate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01175 1-O-Sinapoyl-beta-D-glucose C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01180 4-Methylthio-2-oxobutanoicacid C01182 D-Ribulose1,5-bisphosphate C01185 NicotinateD-ribonucleotide C01186 3S,5S-3,5-Diaminohexanoate C01187 3-Deoxy-D-manno-octulosonate C01188 3-Hydroxy-2-methylpropanoate C01197 3,4-Dihydroxy-trans-cinnamate C01198 3-2-Hydroxyphenylpropanoate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01205 R-3-Amino-2-methylpropanoate C01207 3-3,4-Dihydroxyphenyllactate C01210 N-Methylethanolaminephosphate C01212 UDP-N-acetylmuramoyl-L-alanine C01213 R-2-Methyl-3-oxopropanoyl-CoA C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01230 all-trans-Hexaprenyldiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01249 7,8-Dihydro-7,8-dihydroxykynurenate C01250 N-Acetyl-L-glutamate5-semialdehyde C01251 2-Hydroxybutane-1,2,4-tricarboxylate C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01255 N-6-Aminohexanoyl-6-aminohexanoate C01258 1,2-Didehydropiperidine-2-carboxylate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01262 beta-Alanyl-Npi-methyl-L-histidine C01263 6aS,11aS-3,6a,9-Trihydroxypterocarpan C01265 3',4',5-Trihydroxy-3,7-dimethoxyflavone C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01270 3-Hydroxy-2-methylpyridine-5-carboxylate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01294 1-Guanidino-1-deoxy-scyllo-inositol4-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01328 HO- C01346 dUDP C01352 FADH2 C01353 Carbonicacid C01358 NH4OH C01359 PQQH2 C01367 3'-AMP C01368 3'-UMP C01378 Fustin C01380 Ethyleneglycol C01384 Maleicacid C01390 Prenol C01394 Xylose C01401 Alanine C01403 Anisole C01405 Aspirin C01407 Benzene C01408 Benzoin C01412 Butanal C01414 Casbene C01417 Cyanate C01419 Cys-Gly C01420 Cystine C01424 Gallate C01438 Methane C01444 Oxamate C01454 Toluate C01455 Toluene C01456 Tropate C01467 3-Cresol C01468 4-Cresol C01470 Acacetin C01475 Allysine C01477 Apigenin C01481 Caffeate C01494 Ferulate C01502 o-Methoxyphenol C01504 Indanone C01507 L-Iditol C01508 L-Lyxose C01514 Luteolin C01527 Scopolin C01533 Syringin C01537 Urethane C01542 o-Cresol C01548 Acetylene C01551 Allantoin C01562 Calycosin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01586 Hippurate C01592 Licodione C01594 Linamarin C01596 Maleamate C01598 Melatonin C01602 Ornithine C01606 Phthalate C01613 Stachyose C01616 Tauropine C01617 Taxifolin C01620 Threonate C01623 UDP-apiose C01659 Acrylamide C01667 Bacitracin C01672 Cadaverine C01674 Chitobiose C01678 Cysteamine C01680 D-Fuconate C01682 D-Nopaline C01685 D-Ribonate C01697 Galactitol C01701 --GlyceollinI C01710 Indan-1-ol C01717 4-Hydroxy-2-quinolinecarboxylicacid C01721 L-Fuculose C01724 Lanosterol C01727 Lumichrome C01732 Mesaconate C01742 Palatinose C01745 Pinosylvin C01747 Psychosine C01750 Quercitrin C01751 Resorcinol C01752 Scopoletin C01755 Thiocyanate C01757 Triacetate C01762 Xanthosine C01767 --Carvone C01769 S-Acetoin C01771 2-Butenoate C01772 trans-2-Hydroxycinnamate C01795 Columbamine C01801 Deoxyribose C01817 Homocystine C01818 Hyponitrite C01825 L-Galactose C01832 Lauroyl-CoA C01837 Nitroethane C01841 Pentalenene C01845 Propan-2-ol C01847 ReducedFMN C01850 Rosmarinate C01855 Taxiphyllin C01857 Thioacetate C01860 Trichodiene C01861 Trithionate C01866 beta-Lactam C01877 4-Oxoproline C01879 5-Oxoproline C01880 6-Hexanolide C01888 Aminoacetone C01893 Biotinamide C01894 Biotinyl-CoA C01902 Cycloartenol C01904 D-Arabitol C01909 Dethiobiotin C01929 L-Histidinal C01934 L-Rhamnonate C01944 Octanoyl-CoA C01948 Pentadecanal C01962 Thiocysteine C01982 R-Amygdalin C01983 R-Mandelate C01984 S-Mandelate C01987 2-Aminophenol C01988 2-Nitrophenol C01989 3-Ethylmalate C01990 3-Oxalomalate C01993 5'-Oxoinosine C01996 Acetylcholine C01998 Acrylonitrile C02004 Aristolochene C02013 Cellotetraose C02015 CoA-disulfide C02024 D-Mannuronate C02041 Eicosanoyl-CoA C02043 Indolelactate C02048 Laminaribiose C02059 Phylloquinone C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02090 Trypanothione C02091 Ureidoglycine C02097 dTDP-galactose C02105 S-Reticuline C02106 S-Scoulerine C02107 S,S-Tartaricacid C02115 2-Methylserine C02116 2-Nitropropane C02130 Acetyl-maltose C02132 Acetylpyruvate C02137 alpha-Oxo-benzeneaceticacid C02161 Isophenoxazine C02167 Maleylpyruvate C02170 Methylmalonate C02183 Phloroglucinol C02191 Protoporphyrin C02199 UDP-L-rhamnose C02207 beta-Alanopine C02214 E-Glutaconate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02223 2-Methylbutanal C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02235 4-Nitrocatechol C02236 4-Sulfobenzoate C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02247 Anthranilyl-CoA C02253 Benzoylagmatine C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02274 Dihydrocoumarin C02280 GDP-L-galactose C02291 L-Cystathionine C02294 Methylguanidine C02295 Methylitaconate C02305 Phosphocreatine C02325 Sinapylalcohol C02330 UDP-L-iduronate C02331 Vinylacetyl-CoA C02335 beta-Alanyl-CoA C02336 beta-D-Fructose C02341 trans-Aconitate C02344 --endo-Fenchol C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02360 2-Hydroxyadipate C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02376 5-Methylcytosine C02378 6-Aminohexanoate C02385 AminoacidArg- C02394 Cinnamylalcohol C02405 Formylphosphate C02411 Glutaconyl-1-CoA C02427 L-Homocitrulline C02431 L-Rhamnofuranose C02442 N-Methyltyramine C02452 Perillylalcohol C02457 Propane-1,3-diol C02462 Sabinenehydrate C02463 Precorrin2 C02466 Trimetaphosphate C02469 UroporphyrinIII C02470 Xanthurenicacid C02477 alpha-Tocopherol C02480 cis,cis-Muconate C02483 gamma-Tocopherol C02485 --Isopiperitenone C02486 3R-beta-Leucine C02488 R-2-Ethylmalate C02495 2'-Hydroxydaidzein C02499 2-Hydroxybiphenyl C02501 2-Hydroxymuconate C02504 2S-2-Isopropylmalate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02527 Butanoylphosphate C02532 D-O-Phosphoserine C02557 Methylmalonyl-CoA C02558 N-Acetylarylamine C02564 N-Feruloylglycine C02565 N-Methylhydantoin C02569 Neryldiphosphate C02572 O-Feruloylquinate C02576 Perillylaldehyde C02587 Pyrimidodiazepine C02591 Sucrose6-phosphate C02593 Tetradecanoyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02631 2-Isopropylmaleate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02646 4-Coumarylalcohol C02647 4-Guanidinobutanal C02652 5-Dehydroshikimate C02655 6-Acetyl-D-glucose C02656 6-Carboxyhexanoate C02657 6-Methylsalicylate C02659 Acetonecyanohydrin C02666 Coniferylaldehyde C02669 D-Galactono-1,5-lactone C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02675 DihydrobiochaninA C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02704 Monomethylsulfate C02709 N-Acetoxyarylamine C02710 N-Acetyl-L-leucine C02714 N-Acetylputrescine C02717 N-Feruloyltyramine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02721 N-Methyl-L-alanine C02723 N-Methylputrescine C02726 N4-Phosphoagmatine C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02744 Psychosinesulfate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02780 2,5-Didehydro-D-gluconate C02787 2-Methylpropanamine C02788 2-trans-Hexadecenal C02798 3-Phosphonopyruvate C02800 4,5-Dioxopentanoate C02814 Benzene-1,2,4-triol C02824 Cyclohexylsulfamate C02827 D-Glucose6-sulfate C02835 Imidazole-4-acetate C02837 L-Lysine1,6-lactam C02876 Propanoylphosphate C02887 Sinapoylmalate C02888 Sorbose1-phosphate C02890 Tetrahydropalmatine C02895 Xylitol5-phosphate C02904 p-Menthane-3,8-diol C02906 Dihydromyricetin C02912 R-Propane-1,2-diol C02914 S-2-O-Sulfolactate C02916 S-Norlaudanosoline C02917 S-Propane-1,2-diol C02918 1-Methylnicotinamide C02920 2'-Hydroxyformononetin C02922 2'-O-Methyllicodione C02923 2,3-Dihydroxytoluene C02926 2-Aminobutan-4-olide C02927 2-Caffeoylisocitrate C02930 2-Methyleneglutarate C02934 3-Dehydrosphinganine C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02939 3-Methylbutanoyl-CoA C02944 3-cis-Dodecenoyl-CoA C02946 4-Acetamidobutanoate C02947 4-Coumaroylshikimate C02948 4-Hydroxyhexan-3-one C02949 4-Hydroxybenzoyl-CoA C02954 6-Aminopenicillanate C02964 D-Glucosyl-D-mannose C02977 GDP-6-deoxy-D-talose C02979 Glycerol2-phosphate C02983 L-2-Methyltryptophan C02985 L-Fucose1-phosphate C02991 L-Rhamnono-1,4-lactone C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C02997 N-Acetyl-L-histidine C03002 N-Caffeoylputrescine C03003 N-Glucosylnicotinate C03004 N-Hydroxy-L-tyrosine C03005 N-Methylanthranilate C03012 Naphthalene-1,2-diol C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03034 dTDP-D-galacturonate C03044 R,R-Butane-2,3-diol C03046 S,S-Butane-2,3-diol C03047 1,4-Diguanidinobutane C03052 2,3-Dihydrogossypetin C03056 2,6-Dihydroxypyridine C03057 2-Carboxybenzaldehyde C03058 2-Hydroxyglutaryl-CoA C03063 2-Oxohept-3-enedioate C03064 3-Dehydro-L-threonate C03065 3-Guanidinopropanoate C03067 3-Hydroxybenzaldehyde C03069 3-Methylcrotonyl-CoA C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03087 5-Acetamidopentanoate C03088 5-Hydroxymethyluracil C03089 5-Methylthio-D-ribose C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03107 D-Glucono-1,4-lactone C03112 DeacetylcephalosporinC C03115 Farnesyltriphosphate C03117 GDP-6-deoxy-D-mannose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03141 N-Benzoylanthranilate C03142 N-D-Glucosylarylamine C03145 N-Formyl-L-methionine C03147 N-Malonylanthranilate C03150 N-Ribosylnicotinamide C03153 N5-Methyl-L-glutamine C03160 2-Succinylbenzoyl-CoA C03164 Phenanthrene-3,4-diol C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03170 Oxidizedtrypanothione C03172 S-Methyl-L-methionine C03174 S-Succinylglutathione C03175 Shikimate3-phosphate C03187 dTDP-6-deoxy-L-talose C03190 +-Bornyl-diphosphate C03194 R-1-Aminopropan-2-ol C03198 S-4-Hydroxymandelate C03203 1-Hydroxy-2-naphthoate C03204 10-Formyldihydrofolate C03210 2,2'-Iminodipropanoate C03214 2-Amino-3-oxobutanoate C03217 2-Hydroxy-3-oxoadipate C03221 2-trans-Dodecenoyl-CoA C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03231 3-Methylglutaconyl-CoA C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03239 6-Amino-2-oxohexanoate C03241 6-Hydroxyhexan-6-olide C03246 ADPribose2'-phosphate C03248 Acetylenedicarboxylate C03263 CoproporphyrinogenIII C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03273 5-Oxopentanoate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03284 L-3-Amino-isobutanoate C03287 L-Glutamyl5-phosphate C03289 L-xylo-Hexulonolactone C03290 L-threo-3-Phenylserine C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03296 N2-Succinyl-L-arginine C03319 dTDP-6-deoxy-L-mannose C03329 S-Canadine C03340 L-2,3-Dihydrodipicolinate C03341 2-Amino-4-oxopentanoicacid C03344 2-Methylacetoacetyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03351 3-Hydroxybenzylalcohol C03354 3-Methylthiopropanamine C03360 4-Nitrophenylphosphate C03373 Aminoimidazoleribotide C03375 Bis3-aminopropylamine C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03393 4-Phospho-D-erythronate C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03410 N-Glycoloyl-neuraminate C03415 N2-Succinyl-L-ornithine C03427 Prephytoenediphosphate C03428 Presqualenediphosphate C03431 S-Inosyl-L-homocysteine C03440 cis-4-Hydroxy-D-proline C03442 dTDP-L-dihydrostreptose C03451 R-S-Lactoylglutathione C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03460 2-Methylprop-2-enoyl-CoA C03467 3-Oxo-4-methylpentanoicacid C03479 5-Formyltetrahydrofolate C03483 Adenosinetetraphosphate C03486 CDP-N-methylethanolamine C03492 D-4'-Phosphopantothenate C03493 D-4-Hydroxyphenylglycine C03495 Deoxy-5-methylcytidylate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03515 Luteolin7-O-glucuronide C03519 N-Acetyl-L-phenylalanine C03526 O-Sinapoylglucarolactone C03537 S-Acetylthioethanolamine C03539 S-Ribosyl-L-homocysteine C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03549 2-Hydroxycinnamate C03557 2-Aminoethylphosphonate C03561 R-3-Hydroxybutanoyl-CoA C03564 1-Pyrroline-2-carboxylate C03567 2'-Hydroxydihydrodaidzein C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03582 3,4',5-Trihydroxystilbene C03584 3-Uracil-1-yl-L-alanine C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03590 4-Hydroxyphenylglyoxylate C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03640 Sphingosyl-phosphocholine C03646 Bis-gamma-glutamylcystine C03648 cis-3,4-Leucopelargonidin C03652 2R,3S-2,3-Dimethylmalate C03656 S-5-Amino-3-oxohexanoicacid C03657 1,4-Dihydroxy-2-naphthoate C03659 1-O-Methyl-myo-inositol C03660 3-O-Methyl-myo-inositol C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03672 3-4-Hydroxyphenyllactate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03691 CMP-N-glycoloylneuraminate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03710 N-Benzyloxycarbonylglycine C03712 N2,N5-Dibenzoyl-L-ornithine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03739 trans-Cyclohexane-1,2-diol C03741 S-4-Amino-5-oxopentanoate C03742 S-4-Hydroxymandelonitrile C03750 2,6-Dioxo-6-phenylhexanoate C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03766 4-Hydroxyphenylacetonitrile C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03789 N,6-O-Disulfo-D-glucosamine C03790 N-Carboxymethyl-D-alanine C03794 N6-1,2-Dicarboxyethyl-AMP C03806 Substitutedbeta-aminoacid C03817 S-3-Imidazol-5-yllactate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03851 Adenosine5'-phosphoramidate C03861 Dibenzo1,4dioxin-2,3-dione C03871 L-2-Amino-6-oxoheptanedioate C03872 L-Serine-phosphoethanolamine C03897 Quercetin3,3',7-trissulfate C03898 Quercetin3,4',7-trissulfate C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03914 S-beta-Methylindolepyruvate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03951 Luteolin7-O-beta-D-glucoside C03955 N6-Acetyl-N6-hydroxy-L-lysine C03961 erythro-3-Hydroxy-L-aspartate C03962 --MenthylO-beta-D-glucoside C03964 R-3-4-Hydroxyphenyllactate C03971 1F-alpha-D-Galactosylraffinose C03972 2,3,4,5-Tetrahydrodipicolinate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C03986 3-Hydroxy-4-methylanthranilate C03993 4-beta-D-Glucosyloxybenzoate C03996 5'-O-beta-D-Glucosylpyridoxine C03997 5-Hydroxymethyldeoxycytidylate C04002 But-1-ene-1,2,4-tricarboxylate C04006 1D-myo-Inositol3-phosphate C04015 N-Acetyl-4-O-acetylneuraminate C04016 N-Acetyl-7-O-acetylneuraminate C04017 N-Acetyl-9-O-acetylneuraminate C04020 N2-D-1-Carboxyethyl-L-lysine C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04039 2,3-Dihydroxy-3-methylbutanoate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04047 3-Hydroxy-2-methylpropanoyl-CoA C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04053 5-Dehydro-4-deoxy-D-glucuronate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04076 L-2-Aminoadipate6-semialdehyde C04079 N-R-Pantothenoyl-L-cysteine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04091 cis-1,2-Dihydrobenzene-1,2-diol C04092 delta1-Piperideine-2-carboxylate C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04118 5,8,13,13a-Tetrahydrocolumbamine C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04137 N2-D-1-Carboxyethyl-L-arginine C04138 Nalpha-gamma-L-Glutamylhistamine C04148 alpha-N-Phenylacetyl-L-glutamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04187 5-Methyldeoxycytidinediphosphate C04188 S-Methyl-5-thio-D-ribose1-phosphate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04210 N5-L-1-Carboxyethyl-L-ornithine C04211 N6-Indol-3-ylacetyl-L-lysine C04216 all-trans-Heptaprenyldiphosphate C04217 all-trans-Pentaprenyldiphosphate C04221 trans-1,2-Dihydrobenzene-1,2-diol C04225 Z-But-2-ene-1,2,3-tricarboxylate C04226 6-oxo-1,4,5,6-tetrahydronicotinate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04236 2S-2-Isopropyl-3-oxosuccinate C04244 6-Lactoyl-5,6,7,8-tetrahydropterin C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04268 dTDP-4-amino-4,6-dideoxy-D-glucose C04271 6aR,11aR-3,9-Dihydroxypterocarpan C04272 R-2,3-Dihydroxy-3-methylbutanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C04280 1-Guanidino-1-deoxy-scyllo-inositol C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04290 4-3-Methylbut-2-enyl-L-tryptophan C04293 5,7,4'-Trihydroxy-3'-methoxyflavone C04294 5-2-Hydroxyethyl-4-methylthiazole C04297 CDP-4-dehydro-3,6-dideoxy-D-glucose C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04314 cis-1,2-Dihydronaphthalene-1,2-diol C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04327 4-Methyl-5-2-phosphoethyl-thiazole C04332 6,7-Dimethyl-8-1-D-ribityllumazine C04335 Nalpha-Benzyloxycarbonyl-L-leucine C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04352 R-4'-Phosphopantothenoyl-L-cysteine C04353 Z-4-Hydroxyphenylacetaldehyde-oxime C04359 1-Deoxy-D-altro-heptulose7-phosphate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C04409 2-Amino-3-carboxymuconatesemialdehyde C04411 2R,3S-3-Isopropylmalate C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04425 S-Adenosyl-4-methylthio-2-oxobutanoate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04437 1-5-Phosphoribosylimidazole-4-acetate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04443 3',4',5,7-Tetrahydroxy-3-methoxyflavone C04444 3',5-Dihydroxy-3,4',7-trimethoxyflavone C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04454 5-Amino-6-5'-phosphoribitylaminouracil C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04462 N-Succinyl-2-L-amino-6-oxoheptanedioate C04468 +-cis-3,4-Dihydrophenanthrene-3,4-diol C04471 4S,5S-4,5-Dihydroxy-2,6-dioxohexanoate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04498 N-4-Guanidinobutyl-4-hydroxycinnamide C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04509 di-trans,poly-cis-Decaprenyldiphosphate C04514 1S,2S-1,2-Dihydronaphthalene-1,2-diol C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04524 2-Protocatechoylphloroglucinolcarboxylate C04529 3S,4S-3-Hydroxytetradecane-1,3,4-tricarboxylate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04544 gamma-L-Glutamyl-L-cysteinyl-beta-alanine C04546 R-3-R-3-Hydroxybutanoyloxybutanoate C04547 1,2-Bis4-hydroxy-3-methoxyphenylethylene C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04573 UDP-N-acetyl-2-amino-2-deoxy-D-glucuronate C04574 di-trans,poly-cis-Undecaprenyldiphosphate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C04579 Inositol1,2,3,4,5-pentakisphosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04592 Toluene-cis-dihydrodiol C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04604 3-Hydroxy-2-methylpyridine-4,5-dicarboxylate C04608 Apigenin7-O-beta-D-glucoside C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04634 1,6-Dihydroxycyclohexa-2,4-diene-1-carboxylate C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04642 2-Hydroxy-5-carboxymethylmuconatesemialdehyde C04655 2S,3S-2-Hydroxytridecane-1,2,3-tricarboxylate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04674 3-D-Glucuronosyl-N2,6-disulfo-beta-D-glucosamine C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04700 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysine C04702 UDPMurAcoyl-L-Ala-D-gamma-Glu-L-Lys-D-Ala-D-Ala C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04712 7-5-Carboxyl-5-oxopentanylaminocephalosporinate C04713 N6-delta2-Isopentenyl-adenosine5'-monophosphate C04732 4-1-D-Ribitylamino-5-amino-2,6-dihydroxypyrimidine C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04783 cis-4,5-Dihydroxycyclohexa-16,2-diene-1,2-dicarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C04846 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanyl-D-alanine C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04856 6S-6-beta-Hydroxy-1,4,5,6-tetrahydronicotinamide-adeninedinucleotide C04858 Apigenin7-O-beta-D-apiosyl-1->2-beta-D-glucoside C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04877 UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate C04882 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04900 Luteolin7-O-beta-D-glucuronosyl-1->2-beta-D-glucuronide-4'-O-beta-D-glucuronide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05005 Glycolipid C05100 3-Ureidoisobutyrate C05108 14-Demethyllanosterol C05109 24,25-Dihydrolanosterol C05114 Mucopolysaccharide C05116 3-Hydroxybutanoyl-CoA C05127 N-Methylhistamine C05130 Imidazole-4-acetaldehyde C05131 1-Ribosylimidazole-4-acetate C05133 4-Imidazolone-5-acetate C05135 4-beta-Acetylaminoethylimidazole C05143 Dhurrin C05145 3-Aminoisobutanoate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05161 2,5-Diaminohexanoate C05165 2-Amino-5-oxocyclohex-1-enecarbonyl-CoA C05174 S-Cheilanthifoline C05175 6,7,12b,13e-Tetrahydro-4H-bis1,3benzodioxolo5,6-a:4',5'-gquinolizine C05176 S-N-Methylcoclaurine C05189 Protopine C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine C05193 12-Hydroxydihydrochelirubine C05194 Dihydrochelirubine C05195 3-Hydroxybenzoyl-CoA C05198 5'-Deoxyadenosine C05202 3'-Hydroxy-N-methyl-S-coclaurine C05231 L-3-Aminobutyryl-CoA C05235 Hydroxyacetone C05239 5-Aminoimidazole C05247 10-Hydroxydihydrosanguinarine C05258 S-3-Hydroxyhexadecanoyl-CoA C05259 3-Oxopalmitoyl-CoA C05260 S-3-Hydroxytetradecanoyl-CoA C05261 3-Oxotetradecanoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA C05263 3-Oxododecanoyl-CoA C05264 S-Hydroxydecanoyl-CoA C05265 3-Oxodecanoyl-CoA C05266 S-Hydroxyoctanoyl-CoA C05267 3-Oxooctanoyl-CoA C05268 S-Hydroxyhexanoyl-CoA C05269 3-Oxohexanoyl-CoA C05270 Hexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA C05274 Decanoyl-CoA C05275 trans-Dec-2-enoyl-CoA C05276 trans-Oct-2-enoyl-CoA C05281 5-Methylbarbiturate C05315 Palmatine C05316 Dihydromacarpine C05324 Nicotianamine C05328 D-2-Amino-hexano-6-lactam C05330 Homocysteine C05332 Phenethylamine C05338 4-Hydroxyphenylacetyl-CoA C05340 beta-Alanyl-L-arginine C05341 beta-Alanyl-L-lysine C05343 R-4-Hydroxymandelate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05376 BiochaninA-beta-D-glucoside C05378 beta-D-Fructose1,6-bisphosphate C05379 Oxalosuccinate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05383 Aminosugars C05385 D-Glucuronate1-phosphate C05394 3-Keto-beta-D-galactose C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05403 3-Ketolactose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05411 L-Xylonate C05412 L-Lyxonate C05413 Phytoene C05414 Phytofluene C05421 15-cis-Phytoene C05422 L-Dehydroascorbate C05426 RING C05427 Phytyldiphosphate C05430 zeta-Carotene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C05512 Deoxyinosine C05513 Urate-3-ribonucleoside C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05524 Aminoacyl-L-methionine C05526 S-Glutathionyl-L-cysteine C05527 3-Sulfinylpyruvate C05528 3-Sulfopyruvate C05529 H2S2O3 C05532 SO2 C05533 Oxaloglutarate C05539 N-Acetyl-L-2-amino-6-oxopimelate C05548 6-Acetamido-2-oxohexanoate C05551 PenicillinG C05552 N6-D-Biotinyl-L-lysine C05554 Aerobactin C05556 deltaL-2-Aminoadipyl-L-cysteinyl-D-valine C05557 IsopenicillinN C05560 L-2-Aminoadipateadenylate C05565 Hydantoin-5-propionate C05568 Imidazolelactate C05569 5'-Phospho-D-1-ribulosylformimine C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05576 3,4-Dihydroxyphenylethyleneglycol C05577 3,4-Dihydroxymandelaldehyde C05580 3,4-Dihydroxymandelate C05581 3-Methoxy-4-hydroxyphenylacetaldehyde C05582 Homovanillate C05583 3-Methoxy-4-hydroxyphenylglycolaldehyde C05584 3-Methoxy-4-hydroxymandelate C05585 Gentisatealdehyde C05587 3-Methoxytyramine C05588 L-Metanephrine C05589 L-Normetanephrine C05593 3-Hydroxyphenylacetate C05594 3-Methoxy-4-hydroxyphenylethyleneglycol C05595 4-Hydroxyphenylacetylglutamicacid C05596 4-Hydroxyphenylacetylglycine C05598 Phenylacetylglycine C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05607 Phenyllactate C05608 4-Hydroxycinnamylaldehyde C05610 Sinapoylaldehyde C05616 3-O-Methylgallate C05619 5-Hydroxyferulate C05620 N-Acetyl-D-phenylalanine C05622 Malonylapiin C05623 Quercetin3-O-glucoside C05625 Rutin C05627 4-Hydroxystyrene C05629 Phenylpropanoate C05631 Eriodictyol C05634 5-Hydroxyindoleacetaldehyde C05635 5-Hydroxyindoleacetate C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05638 5-Hydroxykynurenamine C05639 4,6-Dihydroxyquinoline C05640 Cinnavalininate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate C05642 Formyl-N-acetyl-5-methoxykynurenamine C05644 3-Methylindolepyruvate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05646 5-Hydroxyindolepyruvate C05647 Formyl-5-hydroxykynurenamine C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05654 5-2'-Formylethyl-4,6-dihydroxypicolinate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05656 5-3'-Carboxy-3'-oxopropyl-4,6-dihydroxypicolinate C05657 6-Hydroxyindolelactate C05658 Indoxyl C05660 5-Methoxyindoleacetate C05662 Homoisocitrate C05665 beta-Aminopropionaldehyde C05668 3-Hydroxypropionyl-CoA C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05717 alpha-Amino-gamma-cyanobutanoate C05730 Glutathionylspermidine C05731 3-Ketosucrose C05765 L-Glutamyl1-phosphate C05766 UroporphyrinogenI C05768 CoproporphyrinogenI C05772 Precorrin3A C05778 Sirohydrochlorin C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05820 L-Seryladenylate C05822 3'-CMP C05823 3-Mercaptolactate C05824 S-Sulfo-L-cysteine C05825 2-Amino-5-oxohexanoate C05827 Methylimidazoleacetaldehyde C05828 Methylimidazoleaceticacid C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05837 Glucobrassicin C05838 cis-2-Hydroxycinnamate C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05840 Iminoaspartate C05841 NicotinateD-ribonucleoside C05851 Coumarin C05852 2-Hydroxyphenylacetate C05853 Phenylethylalcohol C05854 4-Carboxy-2-oxo-4-pentanoate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C05892 UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysine C05902 3-Methoxyapigenin C05903 Kaempferol C05904 Pelargonidin C05905 Cyanidin C05906 Leucocyanidin C05907 Luteoforol C05908 Delphinidin C05909 Leucodelphinidin C05911 Pentahydroxyflavanone C05921 Biotinyl-5'-AMP C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05928 10-FormyltetrahydrofolylL-glutamate C05931 N-Succinyl-L-glutamate C05932 N-Succinyl-L-glutamate5-semialdehyde C05933 N-omega-Hydroxyarginine C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05938 L-4-Hydroxyglutamatesemialdehyde C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05979 Propane-1-ol C05983 Propinoladenylate C05984 2-Hydroxybutanoicacid C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C05989 3-Oxopropionyl-CoA C05993 Acetyladenylate C05996 Branchedchainfattyacid C05998 3-Hydroxyisovaleryl-CoA C05999 Lactaldehyde C06000 S-3-Hydroxyisobutyryl-CoA C06001 S-3-Hydroxyisobutyrate C06002 S-Methylmalonatesemialdehyde C06004 R-3-Methyl-2-oxobutanoate C06006 S-2-Aceto-2-hydroxybutanoate C06007 R-2,3-Dihydroxy-3-methylpentanoate C06010 S-2-Acetolactate C06011 Benzenaminesulfate C06016 Pentosans C06017 dTDP-D-glucuronate C06018 dTDP-4-acetamido-4,6-dideoxy-D-glucose C06019 D-arabino-3-Hexulose6-phosphate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06044 4-Hydroxyphenylethanol C06045 3-Methoxy-4-hydroxyphenylacetate C06046 Salidroside C06047 Stizolobate C06048 Stizolobinate C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate C06051 Isopyridoxal C06054 2-Oxo-3-hydroxy-4-phosphobutanoate C06055 O-Phospho-4-hydroxy-L-threonine C06056 4-Hydroxy-L-threonine C06057 3-Aminopropane-1,2-diol C06059 Cyclicamidines C06074 Myrcene C06075 Terpinolene C06076 Comphene C06077 Pinene C06083 Tetrahymanol C06084 Hopanoid C06085 Triterpenoid C06086 Pimaradiene C06089 ent-Copalyldiphosphate C06090 ent-Kaurene C06093 GibberellinA12aldehyde C06099 +-Limonene C06101 Hexan-1-ol-6-oate C06102 Adipatesemialdehyde C06103 6-Hydroxyhexanoicacid C06104 Adipate C06105 Cyclohexan-1,2-dione C06111 Nerolidyldiphosphate C06114 gamma-Glutamyl-beta-aminopropiononitrile C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate C06121 3-Ketosphingosine C06123 Hexadecenal C06124 Sphingosine1-phosphate C06142 1-Butanol C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06149 6-3'-Triphosphoryl-1'-methylglyceryl-7-methyl-7,8-dihydrobiopterin C06156 alpha-D-Glucosamine1-phosphate C06159 2-Dehydro-3-deoxy-D-fuconate C06160 S-Norcoclaurine C06161 S-Coclaurine C06162 Sanguinarine C06163 S-cis-N-methylstylopine C06165 Macarpine C06178 1-Methylpyrrolinium C06180 Anabasine C06181 Piperideine C06182 Pelletierine C06183 Anapheline C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06199 Hordenine C06201 2,4-Dihydroxyhept-2-enedioate C06202 Salicylaldehyde C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06205 1,2-Dihydronaphthalene-1,2-diol C06206 Benzoylphosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06212 N-Methylserotonin C06213 N-Methyltryptamine C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06231 Ectoine C06234 4-Methyl-L-glutamate C06240 UDP-N-acetyl-D-mannosaminouronate C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06245 Phylloquinol C06307 --beta-Pinene C06308 --alpha-Pinene C06309 Diplopterol C06310 Diploptene C06311 Galactitol1-phosphate C06312 L-Tagatose6-phosphate C06313 Biopterin C06316 D-erythro-Ascorbate C06317 4-Hydroxy-3-methoxy-benzenemethanol C06318 3S,4R-3,4-Dihydroxycyclohexa-1,5-diene-1,4-dicarboxylate C06319 Precorrin6Y C06320 Precorrin6X C06321 1,6-Dihydroxy-cis-2,4-cyclohexadiene-1-carboxylicacid C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06327 Chelirubine C06330 Quinoline-3,4-diol C06333 2-Aminobenzenesulfonate C06335 4-Aminobenzenesulfonate C06336 3-Sulfocatechol C06337 Terephthalate C06343 Quinolin-4-ol C06352 4-O-Methyl-myo-inositol C06353 6-O-Methyl-myo-inositol C06355 2,3',4,6-Tetrahydroxybenzophenone C06356 2,4,6-Trihydroxybenzophenone C06358 Methylcinnamate C06359 Ethylcinnamate C06360 Propylcinnamate C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06394 +-delta-Cadinene C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06399 Hydrogenobyrinate C06406 Precorrin3B C06407 Precorrin4 C06408 Precorrin8X C06416 Precorrin5 C06430 D-Galacturonolactone C06432 UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-L-lysyl-D-alanine C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06442 N-gamma-Acetyldiaminobutyrate C06503 Hydrogenobyrinatea,cdiamide C06517 S-6-O-Methylnorlaudanosoline C06518 S-Nororientaline C06519 S-3'-Hydroxycoclaurine C06520 S-Norreticuline C06547 Ethylene C06548 Ethyleneoxide C06554 Cyanuricacid C06555 Biuret C06561 Isosalipurpol C06562 +-Catechin C06563 Genistein C06564 PenicillinN C06565 DeacetoxycephalosporinC C06566 CephamycinC C06568 O-Carbamoyl-deacetylcephalosporinC C06569 7a-Hydroxy-o-carbamoyl-deacetylcephalosporinC C06588 Biphenyl C06589 cis-2,3-Dihydro-2,3-dihydroxybiphenyl C06593 epsilon-Caprolactam C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06625 Malonamoyl-CoA C06631 dTDP-beta-L-mycarose C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06672 Vanillate C06673 4-Carboxy-4'-sulfoazobenzene C06674 4-Sulfocatechol C06675 3-Sulfomuconate C06676 4-Sulfolactone C06677 Toluene-4-sulfonate C06678 4-Sulfobenzylalcohol C06679 4-Sulfobenzaldehyde C06680 4-Hydroxyphthalate C06701 Phosphonate C06711 Fluoren-9-ol C06712 Fluoren-9-one C06714 3-Hydroxypimeloyl-CoA C06715 3-Oxopimeloyl-CoA C06719 Dihydrophloroglucinol C06720 1,6-Dihydroxy-5-methylcyclohexa-2,4-dienecarboxylate C06723 6-Carboxyhex-2-enoyl-CoA C06727 cis-1,2-Dihydro-3-ethylcatechol C06728 3-Ethylcatechol C06729 cis-1,2-Dihydroxy-4-methylcyclohexa-3,5-diene-1-carboxylate C06730 4-Methylcatechol C06731 1,2-Dihydroxy-6-methylcyclohexa-3,5-dienecarboxylate C06732 alpha,beta-Didehydrotryptophan C06735 Aminoacetaldehyde C06736 E-11-Tetradecenoyl-CoA C06737 Z-11-Tetradecenoyl-CoA C06742 2-2-Hydroxyphenylbenzenesulfinate C06746 N-Acetylphenylethylamine C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C06756 p-Xylene C06757 4-Methylbenzylalcohol C06758 p-Tolualdehyde C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06876 Nitrosobenzene C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C06986 Spirodilactone C07024 3'-Keto-3'-deoxy-ATP C07025 3'-Keto-3'-deoxy-AMP C07083 Styrene C07084 Styrenecis-glycol C07085 3-Vinylcatechol C07086 Phenylaceticacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07103 2-Hydroxy-1,4-benzoquinone C07111 Ethylbenzene C07112 1-Phenylethanol C07113 Acetophenone C07114 Benzoylacetate C07118 Benzoylacetyl-CoA C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07130 Theophylline C07189 2-Hydroxyacetophenone C07208 m-Xylene C07209 3-Methylbenzaldehyde C07211 m-Methylbenzoate C07212 o-Xylene C07213 2-Methylbenzylalcohol C07214 2-Methylbenzaldehyde C07215 o-Toluate C07216 3-Methylbenzylalcohol C07271 Limonene-1,2-epoxide C07272 Maleimide C07276 Limonene-1,2-diol C07277 dTDP-D-fucose C07301 R-Mandelamide C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA C07305 ProductsofATPbreakdown C07331 Carbonylsulfide C07335 2-Amino-3-oxo-4-phosphonooxybutyrate C07350 3-Methyl-1-2,4,6-trihydroxyphenylbutan-1-one C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07480 Theobromine C07481 Caffeine C07715 Fluorene C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07719 2-Formyl-1-indanone C07720 3-Hydroxy-1-indanone C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07726 1-Formyl-2-indanone C07729 Dibenzofuran C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07732 Dibenzo-p-dioxin C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07756 7-Aminocephalosporanicacid C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08060 Carbazole C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08063 1,4-Cyclohexanedione C08276 3-Methylthiopropionicacid C08481 Indican C08576 Aureusidin C08577 Bracteatin C08578 Butein C08586 delta-Carotene C08604 Cyanidin3-O-glucoside C08615 alpha-Amyrin C08616 beta-Amyrin C08620 Cyanidin3-O-rutinoside C08628 Lupeol C08639 Cyanin C08650 Isoliquiritigenin C08725 Pelargonin C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C08830 24-Methylenecycloartanol C08980 SoyasapogenolB C09099 Naringenin7-O-beta-D-glucoside C09126 Genistein7-O-beta-D-glucoside C09306 Sulfurdioxide C09320 Afzelechin C09332 Tetrahydrofolyl-Glu2 C09614 Butin C09727 --Epicatechin C09736 Fisetinidol-4beta-ol C09751 Garbanzol C09756 Homoeriodictyol C09762 Liquiritigenin C09789 Naringin C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA C09814 Benzonitrile C09815 Benzamide C09816 Benzylsuccinate C09817 Benzylsuccinyl-CoA C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA C09820 Benzoylsuccinyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA C09826 Pinobanksin C09827 Pinocembrin C09893 Pulegone C10020 Apigenin7-6''-malonylglucoside C10098 Kaempferide C10107 Myricetin C10175 Quercetin3-2G-xylosylrutinoside C10192 Tricetin C10200 Anhydroglycinol C10208 Daidzein C10216 Daidzin C10419 Ferreirin C10422 --GlyceollinII C10434 5-O-Caffeoylshikimicacid C10502 --Maackiain C10503 --Medicarpin C10509 Ononin C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C10520 Pratensein C10521 Prunetin C10522 Pseudobaptigenin C10538 Trifolirhizin C10700 4'-Hydroxyacetophenone C10906 D-Fructose C10945 Caffeicaldehyde C10974 4-Methylaminobutanal C11038 2'-Deoxy-5-hydroxymethylcytidine-5'-diphosphate C11039 2'-Deoxy-5-hydroxymethylcytidine-5'-triphosphate C11062 4-Hydroxybutyryl-CoA C11130 3-Hydroxyindolin-2-one C11174 1-Diphosinositolpentakisphosphate C11249 Cyclohexane C11348 S-1-Phenylethanol C11354 2-Hydroxy-cis-hex-2,4-dienoate C11355 4-Amino-4-deoxychorismate C11356 trans,trans,cis-Geranylgeranyldiphosphate C11383 +-S-Carvone C11388 --Linalool C11389 +-Linalool C11395 4R,6R-cis-Carveol C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate C11408 4S,6S-cis-Carveol C11409 +-trans-Carveol C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol C11422 Phenanthracene C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C11427 1-Hydroxy-2-naphthaldehyde C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol C11434 2-C-Methyl-D-erythritol4-phosphate C11435 4-Cytidine5'-diphospho-2-C-methyl-D-erythritol C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11437 1-Deoxy-D-xylulose5-phosphate C11453 2-C-Methyl-D-erythritol2,4-cyclodiphosphate C11455 4,4-Dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol C11457 3-3-Hydroxy-phenyl-propanoicacid C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11481 HSO3- C11499 S-3-Sulfolactate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11513 24R-24-Methylcycloarta-25-en-3-beta-ol C11514 E-3-Methoxycarbonylpent-2-enedioate C11515 E-2-Methoxycarbonylmethylbutenedioate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide C11521 UDP-6-sulfoquinovose C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11536 2R-O-Phospho-3-sulfolactate C11537 2R-3-Sulfolactate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11588 cis-3-Carboxy-ethyl-3,5-cyclo-hexadiene-1,2-diol C11620 Syringetin C11631 9-Riburonosylhypoxanthine C11638 3-Amino-2-oxopropylphosphate C11713 beta-Naphthol C11714 alpha-Naphthol C11811 1-Hydroxy-2-methyl-2-butenyl4-diphosphate C11818 R-Canadine C11821 5-Hydroxyisourate C11822 2-Aminomalonatesemialdehyde C11824 Cyclicamide C11838 S-4,5-dihydroxypentan-2,3-dione C11857 GibberellinA12 C11859 GibberellinA37openlactone C11860 GibberellinA15openlactone C11861 GibberellinA24 C11862 GibberellinA36 C11872 Kaur-16-en-18-ol C11873 Kaur-16-en-18-al C11874 Kaur-16-en-18-oicacid C11875 ent-7alpha-Hydroxykaur-16-en-19-oicacid C11876 6beta,7beta-Dihydroxykaurenoicacid C11877 +-Sandaracopimaradiene C11878 --Abietadiene C11879 Levopimaradiene C11880 Neoabietadiene C11881 Palustradiene C11894 Taxa-45,1112-diene C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11915 dTDP-3-methyl-4-oxo-2,6-dideoxy-L-glucose C11916 dTDP-L-mycarose C11920 dTDP-L-olivose C11921 dTDP-L-oleandrose C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose C11924 Perillicacid C11925 dTDP-3-amino-3,6-dideoxy-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose C11929 Perillyl-CoA C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose C11933 dTDP-D-mycaminose C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA C11937 1S,4R-1-Hydroxy-2-oxolimonene C11951 +-cis-Isopulegone C11952 +-Isomenthone C12092 N-Methylanthraniloyl-CoA C12093 1,3-Dihydroxy-N-methylacridone C12095 Cyanidin3-O-6-O-p-coumaroylglucoside C12096 Cyanidin3-O-6-O-p-coumaroylglucoside-5-O-glucoside C12123 7,4'-Dihydroxyflavone C12124 Apiforol C12125 Isoformononetin C12127 +-Gallocatechin C12128 --Epiafzelechin C12134 2'-Hydroxygenistein C12135 2'-HydroxybiochaninA C12136 --Epigallocatechin C12137 Pelargonidin3-O-glucoside C12138 Delphinidin3-O-glucoside C12142 Vetispiradiene C12144 Phytosphingosine C12203 5-Hydroxyferuloyl-CoA C12204 5-Hydroxyconiferaldehyde C12205 5-Hydroxyconiferylalcohol C12206 Caffeylalcohol C12208 p-Coumaroylquinicacid C12209 Caffeoylquinicacid C12210 UDP-3-ketoglucose C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12249 Kaempferol3-O-glucoside C12312 Indolin-2-one C12313 cis-Cyclohexane-1,2-diol C12314 1-Oxa-2-oxo-3-hydroxycycloheptane C12316 cis-Dihydroquercetin C12318 dTDP-3-amino-2,3,6-trideoxy-D-threo-hexopyranos-4-ulose C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12321 dTDP-L-epivancosamine C12322 dTDP-L-vancosamine C12323 L-4-Hydroxyphenylglycine C12455 5-Aminopentanal C12456 3-Dimethylallyl-4-hydroxyphenylpyruvate C12457 3-Dimethylallyl-4-hydroxymandelicacid C12458 3-Dimethylallyl-4-hydroxybenzoate C12481 dTDP-5-dimethyl-L-lyxose C12621 trans-3-Hydroxycinnamate C12622 cis-3-3-Carboxyethenyl-3,5-cyclohexadiene-1,2-diol C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12625 BiochaninA7-O-6-O-malonyl-beta-D-glucoside C12626 Kaempferol3-O-beta-D-galactoside C12627 Apigenin7-O-neohesperidoside C12630 Luteolin7-O-neohesperidoside C12631 2-Hydroxy-2,3-dihydrogenistein C12632 Luteolin7-O-beta-D-glucuronosyl-1->2-beta-D-glucuronide C12633 Laricitrin C12634 Kaempferol3-O-beta-D-glucosyl-1->2-beta-D-glucoside C12635 Kaempferol3-O-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12636 Kaempferol3-O-6-4-coumaroyl-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12637 Quercetin3-O-beta-D-xylosyl-1->2-beta-D-glucoside C12638 Quercetin3-O-6-O-malonyl-beta-D-glucoside C12639 Quercetin7-O-beta-D-glucoside C12640 Pelargonidin3-O-6-caffeoyl-beta-D-glucoside5-O-beta-D-glucoside C12641 4'''-Demalonylsalvianin C12642 Pelargonidin3-O-6-O-malonyl-beta-D-glucoside C12643 Cyanidin3-O-6-O-malonyl-beta-D-glucoside C12644 Pelargonidin3-O-rutinoside C12645 Pelargonidin3-O-rutinoside5-O-beta-D-glucoside C12646 Cyanidin3-O-rutinoside5-O-beta-D-glucoside C12647 Salvianin C12667 Quercetin3-O-beta-D-glucosyl-1->2-beta-D-glucoside C12668 Quercetin3-O-beta-D-glucosyl-1->2-beta-D-glucosyl-1->2-beta-D-glucoside C12838 trans-4-Carboxymethylenebut-2-en-4-olide C12986 N2-Acetyl-L-aminoadipate C12987 N2-Acetyl-L-aminoadipyl-delta-phosphate C12988 N2-Acetyl-L-aminoadipatesemialdehyde C12989 N2-Acetyl-L-lysine C13309 2-Phytyl-1,4-naphthoquinone C13425 3-Hexaprenyl-4-hydroxybenzoate C13482 Phosphodimethylethanolamine C13624 BisphenolA C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13631 2,2-Bis4-hydroxyphenyl-1-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene C13633 2,2-Bis4-hydroxyphenyl-propanoicacid C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13637 4-Ethylphenol C13638 1-4'-Hydroxyphenylethanol C13747 1,7-Dimethylxanthine C13952 UDP-N-acetyl-D-galactosaminuronicacid C14082 1-Methylnaphthalene C14083 cis-1,2-Dihydroxy-1,2-dihydro-8-methylnaphthalene C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14087 3-Methylsalicylaldehyde C14088 3-Methylsalicylate C14089 1-Hydroxymethylnaphthalene C14090 1-Naphthaldehyde C14091 1-Naphthoicacid C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14103 4-Methylsalicylate C14143 Adipyl-CoA C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA C14146 alpha-Zeacarotene C14151 delta-Tocopherol C14152 beta-Tocopherol C14179 Sulfoacetate C14180 S-Hydroxymethylglutathione C14314 4',6,7-Trihydroxyisoflavone C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14783 1,2-Naphthoquinone C14784 1,2-Dihydroxy-3,4-epoxy-1,2,3,4-tetrahydronaphthalene C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15483 D-Galactonolactone C15485 2'-Deoxymugineicacid C15486 3''-Deamino-3''-oxonicotianamine C15499 Pentane-2,4-dione C15500 Mugineicacid C15501 3-Epihydroxymugineicacid C15502 3-Epihydroxy-2'-deoxymugineicacid C15503 N,N-Dihydroxy-L-tyrosine C15509 2-Dimethylallyl-6aS,11aS-3,6a,9-trihydroxypterocarpan C15510 4-Dimethylallyl-6aS,11aS-3,6a,9-trihydroxypterocarpan C15511 GlyceollinIII C15522 4a-Hydroxytetrahydrobiopterin C15523 2,6-Dihydroxynicotinate C15524 Phenylglyoxylyl-CoA C15525 Eriodictyolchalcone C15526 3-Methylhistamine C15527 Precorrin1 C15530 Corydaline C15531 2'-O-Methylisoliquiritigenin C15532 N-Acetyl-L-citrulline C15536 DihydromonacolinL C15547 1,4-Dihydroxy-2-naphthoyl-CoA C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15567 2,7,4'-Trihydroxyisoflavanone C15585 myo-Inositolphosphate C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15601 Glyceollin C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15607 3-Oxo-3-ureidopropanoate C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate C15666 7R-7-4-Carboxybutanamidocephalosporanate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15769 HBOA C15770 DIBOA C15772 DIBOA-glucoside C15804 p-Hydroxyphenyllignin C15805 Guaiacyllignin C15806 Syringyllignin C15807 5-Hydroxy-guaiacyllignin C15809 Iminoglycine C15810 C15810 C15811 C15811 C15812 C15812 C15813 C15813 C15814 C15814 C15815 C15815 C15853 Dehydrospermidine C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15874 3,4-Dehydrorhodopin C15877 Anhydrorhodovibrin C15878 Rhodovibrin C15879 Hydroxyspirilloxanthin C15881 Spirilloxanthin C15882 2-Methyl-6-phytylquinol C15883 2,3-Dimethyl-5-phytylquinol C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin C15888 3,4,3',4'-Tetrahydrospirilloxanthin C15892 Chloroxanthin C15898 Demethylspheroidene C15900 Spheroidene C15902 Hydroxyspheroidene C15903 Spheroidenone C15905 Hydroxyspheroidenone C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C15915 4,4-Dimethyl-5alpha-cholesta-8-en-3beta-ol C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15930 L-Galactonate C15980 S-2-Methylbutanoyl-CoA C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16028 Amorpha-4,11-diene C16069 3-Sulfolactate C16071 Riboflavincyclic-4',5'-phosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16141 +-GermacreneA C16142 --GermacreneD C16143 1E,4S,5E,7R-Germacra-110,5-dien-11-ol C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16153 UDP-L-Ara4N C16154 UDP-L-Ara4FN C16155 UDP-L-Ara4O C16159 2-Formylglutarate C16186 L-Ascorbate6-phosphate C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16190 2,7-Dihydroxy-4'-methoxyisoflavanone C16191 Malonyldaidzin C16192 Malonylgenistin C16199 5-Sulfosalicylate C16201 1-Naphthalenesulfonicacid C16202 2-Naphthalenesulfonicacid C16215 1,2-Dihydrophthalicacid C16216 3-Oxostearoyl-CoA C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA C16222 Formononetin7-O-glucoside-6''-O-malonate C16223 --Medicocarpin C16224 Medicarpin3-O-glucoside-6'-malonate C16225 --Vestitol C16226 2',7-Dihydroxy-4',5'-methylenedioxyisoflavone C16227 +-Sophorol C16228 --Sophorol C16229 +-Maackiain C16231 --Maackiain-3-O-glucosyl-6''-O-malonate C16232 6,7,4'-Trihydroxyflavanone C16233 2,6,7,4'-Tetrahydroxyisoflavanone C16234 o-Nitrobenzoate C16235 o-Hydroxylaminobenzoate C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16267 Cyclopropanecarboxylate C16268 Cyclopropanecarboxyl-CoA C16269 epi-Isozizaene C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16276 epsilon-Carotene C16288 Pelargonidin3-O-3'',6''-O-dimalonylglucoside C16289 Cyanidin3-O-3'',6''-O-dimalonylglucoside C16290 Delphinidin3-O-3'',6''-O-dimalonylglucoside C16297 Pelargonidin3-O-6-caffeoyl-beta-D-glucoside C16299 Malonylshisonin C16301 Delphinidin3-O-6-O-malonyl-beta-D-glucoside C16303 TernatinC5 C16304 Delphinidin3-O-6''-O-malonyl-beta-glucoside-3'-O-beta-glucoside C16305 Pelargonidin3-O-sophoroside C16306 Cyanidin3-O-sophoroside C16307 Delphinidin3-O-sophoroside C16312 Delphin C16313 Delphinidin3-glucoside5-caffoyl-glucoside C16314 Delphinidin3,5,3'-triglucoside C16315 Tulipanin C16349 Pelargonidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16350 Cyanidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16351 Delphinidin3-O-beta-D-glucoside5-O-6-coumaroyl-beta-D-glucoside C16352 7-Methylxanthosine C16353 7-Methylxanthine C16354 Albireodelphin C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16357 3-Methylxanthine C16358 1-Methylxanthine C16359 1-Methyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea C16367 Delphinidin3-O-6-caffeoyl-beta-D-glucoside C16368 Pelargonidin3-6-p-coumaroylglucoside C16369 Cyanidin3-6-p-caffeoylglucoside C16370 Delphinidin3-6-p-coumaroylglucoside C16371 Pelargonidin3-glucoside5-caffeoylglucoside C16372 Cyanidin3-glucoside5-caffeoylglucoside C16373 Cyanidin-3-O-6''-O-malonyl-2''-O-glucuronylglucoside C16390 S-2-Hydroxymethylglutarate C16404 Pinocembrinchalcone C16405 Homoeriodictyolchalcone C16406 Phlorizinchalcone C16415 5-Deoxyleucopelargonidin C16416 Desmethylxanthohumol C16423 Naringinchalcone C16432 5-Hydroxyectoine Consensus scope of cluster 16 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15791 Teasterone C15792 3-Dehydroteasterone C15793 Typhasterol C15794 Castasterone C15797 22alpha-Hydroxy-5alpha-campestan-3-one C15798 6-Deoxocathasterone C15799 6-Deoxoteasterone C15800 3-Dehydro-6-deoxoteasterone C15801 6-Deoxotyphasterol C15802 6-Deoxocastasterone C15803 6alpha-Hydroxy-castasterone Consensus scope of cluster 17 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01226 12-OPDA C04594 9Z-13S-12,13-Epoxyoctadeca-9,11-dienoicacid C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C06427 9Z,12Z,15Z-Octadecatrienoicacid C16309 Traumatin C16310 3-Hexenal C16311 12-Oxo-9Z-dodecenoicacid C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16322 9-Oxononanoicacid C16323 3,6-Nonadienal C16324 9,10-EOT C16325 10-OPDA Consensus scope of cluster 18 C00001 H2O C00080 H+ C03309 Strictosidineaglycone C03677 4,21-Dehydrogeissoschizine C09107 Catharanthine C09244 Tabersonine C11678 Dialdehyde C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Consensus scope of cluster 19 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00472 p-Benzoquinone C00530 p-Benzenediol C00704 O2.- C02222 2-Maleylacetate C02814 Benzene-1,2,4-triol C03676 3-Hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C12838 trans-4-Carboxymethylenebut-2-en-4-olide Consensus scope of cluster 20 C00001 H2O C01054 S-2,3-Epoxysqualene C01724 Lanosterol C01902 Cycloartenol C06085 Triterpenoid C08615 alpha-Amyrin C08616 beta-Amyrin C08628 Lupeol Consensus scope of cluster 21 C00001 H2O C00877 Crotonoyl-CoA C01144 S-3-Hydroxybutanoyl-CoA C02331 Vinylacetyl-CoA C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Consensus scope of cluster 22 C00001 H2O C00011 CO2 C00090 Catechol C00196 2,3-Dihydroxybenzoate C00230 3,4-Dihydroxybenzoate C00944 3-Dehydroquinate C01353 Carbonicacid C02637 3-Dehydroshikimate C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate Consensus scope of cluster 23 C00001 H2O C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00124 D-Galactose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00243 Lactose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00492 Raffinose C00514 D-Mannonate C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01613 Stachyose C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C03971 1F-alpha-D-Galactosylraffinose C05399 Melibiitol C05400 Epimelibiose C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Consensus scope of cluster 24 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00072 Ascorbate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00425 Dehydroascorbate C00704 O2.- C00800 L-Gulonate C00975 Dihydroxyfumarate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01115 L-Galactono-1,4-lactone C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01620 Threonate C03289 L-xylo-Hexulonolactone C03459 2-Hydroxy-3-oxosuccinate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05411 L-Xylonate C05412 L-Lyxonate C05422 L-Dehydroascorbate C15930 L-Galactonate Consensus scope of cluster 25 C00001 H2O C11396 1R,2R,4R-Dihydrocarveol C11397 1R,2S,4R-Neo-dihydrocarveol C11398 1R,4R-Dihydrocarvone C11399 1S,2S,4R-Iso-dihydrocarveol C11400 1S,2R,4R-Neoiso-dihydrocarveol C11401 1S,4R-Iso-dihydrocarvone Consensus scope of cluster 26 C00001 H2O C00080 H+ C11383 +-S-Carvone C11408 4S,6S-cis-Carveol C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol Consensus scope of cluster 27 C00001 H2O C14453 4-Bromophenol C14839 Bromobenzene-3,4-oxide C14843 4-Bromocatechol C14844 Bromobenzene-3,4-dihydrodiol C14845 4-Bromophenol-2,3-epoxide C14846 4-Bromo-3,5-cyclohexadiene-1,2-dione Consensus scope of cluster 28 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01693 L-Dopachrome C03459 2-Hydroxy-3-oxosuccinate C04185 5,6-Dihydroxyindole-2-carboxylate C05578 5,6-Dihydroxyindole C05579 Indole-5,6-quinone C05604 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole C05606 Melanin C15566 D-Dopachrome Consensus scope of cluster 29 C00001 H2O C08650 Isoliquiritigenin C09762 Liquiritigenin C10200 Anhydroglycinol C10208 Daidzein C12123 7,4'-Dihydroxyflavone C15567 2,7,4'-Trihydroxyisoflavanone Consensus scope of cluster 30 C00001 H2O C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00257 D-Gluconicacid C00514 D-Mannonate C00817 D-Altronate Consensus scope of cluster 31 C00001 H2O C00011 CO2 C00048 Glyoxylate C00168 Hydroxypyruvate C00266 Glycolaldehyde C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 32 C00001 H2O C00751 Squalene C06083 Tetrahymanol C06084 Hopanoid C06309 Diplopterol C06310 Diploptene Consensus scope of cluster 33 C00001 H2O C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 34 C00001 H2O C00843 --Menthone C02485 --Isopiperitenone C09893 Pulegone C11951 +-cis-Isopulegone C11952 +-Isomenthone Consensus scope of cluster 35 C00001 H2O C08585 Capsorubin C08606 Neoxanthin C08614 Violaxanthin C13431 9'-cis-Neoxanthin C13433 9-cis-Violaxanthin Consensus scope of cluster 36 C00001 H2O C06205 1,2-Dihydronaphthalene-1,2-diol C11713 beta-Naphthol C11714 alpha-Naphthol C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide Consensus scope of cluster 37 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01595 Linoleate C04056 9-cis,11-trans-Octadecadienoate C04717 9Z,11E-13S-13-Hydroperoxyoctadeca-9,11-dienoicacid C07338 9Z,12Z-11S-11-Hydroperoxyoctadeca-9,12-dienoicacid C07354 7S,8S-DiHODE C14827 9S-HPODE C14831 8R-HPODE Consensus scope of cluster 38 C00001 H2O C00136 Butanoyl-CoA C00630 2-Methylpropanoyl-CoA C02939 3-Methylbutanoyl-CoA C05996 Branchedchainfattyacid C15980 S-2-Methylbutanoyl-CoA Consensus scope of cluster 39 C00001 H2O C00122 Fumarate C00149 S-Malate C00497 R-Malate C01384 Maleicacid Consensus scope of cluster 40 C00001 H2O C00007 Oxygen C00027 H2O2 C00059 Sulfate C00080 H+ C00087 Sulfur C00094 Sulfite C00283 Hydrogensulfide C00320 Thiosulfate C00704 O2.- C01861 Trithionate C11481 HSO3- Consensus scope of cluster 41 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00536 Triphosphate C02466 Trimetaphosphate Consensus scope of cluster 42 C00001 H2O C00010 CoA C00011 CO2 C00042 Succinate C00091 Succinyl-CoA C00100 Propanoyl-CoA C00683 S-2-Methyl-3-oxopropanoyl-CoA C01213 R-2-Methyl-3-oxopropanoyl-CoA C01353 Carbonicacid C02170 Methylmalonate C02557 Methylmalonyl-CoA Consensus scope of cluster 43 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00137 myo-Inositol C00191 D-Glucuronate C00704 O2.- C00905 D-Fructuronate C02670 D-Glucuronolactone C03387 D-Glucurono-6,2-lactone Consensus scope of cluster 44 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00093 sn-Glycerol3-phosphate C00116 Glycerol C00536 Triphosphate C00623 Glycerol1-phosphate C00969 3-Hydroxypropanal C02466 Trimetaphosphate C02979 Glycerol2-phosphate C03947 Glycerol1,2-cyclicphosphate C05999 Lactaldehyde Consensus scope of cluster 45 C00001 H2O C00032 Heme C05783 Cytochromea C05784 Catalase C05785 Peroxidase Consensus scope of cluster 46 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00376 Retinal C00704 O2.- C00777 Retinoate C02094 beta-Carotene C02110 11-cis-Retinal C05918 all-trans-Dehydroretinal C05919 11-cis-Dehydroretinal C15943 Isorenieratene C16340 beta-Isorenieratene Consensus scope of cluster 47 C00001 H2O C00007 Oxygen C00010 CoA C00027 H2O2 C00080 H+ C00136 Butanoyl-CoA C00630 2-Methylpropanoyl-CoA C00704 O2.- C02939 3-Methylbutanoyl-CoA C03345 2-Methylbut-2-enoyl-CoA C03460 2-Methylprop-2-enoyl-CoA C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C05996 Branchedchainfattyacid C06000 S-3-Hydroxyisobutyryl-CoA C06001 S-3-Hydroxyisobutyrate C15980 S-2-Methylbutanoyl-CoA Consensus scope of cluster 48 C00001 H2O C02226 2-Methylmaleate C02612 R-2-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate Consensus scope of cluster 49 C00001 H2O C04053 5-Dehydro-4-deoxy-D-glucuronate C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate Consensus scope of cluster 50 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00266 Glycolaldehyde C00536 Triphosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C02466 Trimetaphosphate C03684 6-Pyruvoyltetrahydropterin C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine Consensus scope of cluster 51 C00001 H2O C00333 D-Galacturonate C00558 D-Tagaturonate C02273 Digalacturonate C06430 D-Galacturonolactone Consensus scope of cluster 52 C00001 H2O C01255 N-6-Aminohexanoyl-6-aminohexanoate C02378 6-Aminohexanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C06593 epsilon-Caprolactam Consensus scope of cluster 53 C00001 H2O C01327 HCl C06594 1,2,4-Trichlorobenzene C06595 gamma-Hexachlorocyclohexane C06596 gamma-Pentachlorocyclohexene C06597 1,3,4,6-Tetrachloro-1,4-cyclohexadiene C06598 2,4,5-Trichloro-2,5-cyclohexadiene-1-ol C06599 2,5-Dichloro-2,5-cyclohexadiene-1,4-diol C06602 2,5-Dichlorophenol Consensus scope of cluster 54 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00088 Nitrite C00189 Ethanolamine C00192 Hydroxylamine C00244 Nitrate C00266 Glycolaldehyde C00282 Hydrogen C00697 Nitrogen C00704 O2.- C01548 Acetylene C01837 Nitroethane C05359 e- C05360 Diimine C05361 Hydrazine C06771 Triethanolamine C06772 Diethanolamine Consensus scope of cluster 55 C00001 H2O C00691 2,4,6/3,5-Pentahydroxycyclohexanone C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid Consensus scope of cluster 56 C00001 H2O C06714 3-Hydroxypimeloyl-CoA C06723 6-Carboxyhex-2-enoyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 57 C00001 H2O C00080 H+ C02880 Protochlorophyllide C04536 Magnesiumprotoporphyrinmonomethylester C11829 131-Hydroxy-magnesium-protoporphyrinIX13-monomethylester C11830 131-Oxo-magnesium-protoporphyrinIX13-monomethylester C11831 Divinylprotochlorophyllide Consensus scope of cluster 58 C00001 H2O C12415 Nogalonicacidmethylester C12417 Auraviketone C12418 Dihydro-NAME C12419 Auramycinone Consensus scope of cluster 59 C00001 H2O C00509 Naringenin C06561 Isosalipurpol C06563 Genistein C12631 2-Hydroxy-2,3-dihydrogenistein Consensus scope of cluster 60 C00001 H2O C13620 TetrabromobisphenolA C13621 TribromobisphenolA C13622 DibromobisphenolA C13623 MonobromobisphenolA C13624 BisphenolA C13645 Hydrobromicacid Consensus scope of cluster 61 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00536 Triphosphate C02466 Trimetaphosphate C04188 S-Methyl-5-thio-D-ribose1-phosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate Consensus scope of cluster 62 C00001 H2O C04525 Fecosterol C15777 Episterol C15780 5-Dehydroepisterol C15781 24-Methylenecholesterol Consensus scope of cluster 63 C00001 H2O C05418 Cholesterol-5beta,6beta-epoxide C05419 Cholesterol-5alpha,6beta-epoxide C05425 3beta,5alpha,6beta-Cholestanetriol C15992 Cholesterol-5alpha,6alpha-epoxide Consensus scope of cluster 64 C00001 H2O C00115 Chloride C01327 HCl C01407 Benzene C06988 beta-1,2,3,4,5,6-Hexachlorocyclohexane C06989 delta-3,4,5,6-Tetrachlorocyclohexene C06990 Chlorobenzene C11352 5,6-Dichloro-1,3-cyclohexadiene C16181 beta-2,3,4,5,6-Pentachlorocyclohexanol C16182 beta-2,3,5,6-Tetrachloro-1,4-cyclohexanediol Consensus scope of cluster 65 C00001 H2O C00786 --Vestitone C10503 --Medicarpin C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16225 --Vestitol Consensus scope of cluster 66 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- Consensus scope of cluster 67 C00001 H2O C00121 D-Ribose C00216 D-Arabinose C00309 D-Ribulose Consensus scope of cluster 68 C00001 H2O C00181 D-Xylose C00310 D-Xylulose C00476 D-Lyxose Consensus scope of cluster 69 C00001 H2O C00041 L-Alanine C00133 D-Alanine C00993 D-Alanyl-D-alanine Consensus scope of cluster 70 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00058 Formate C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00488 Formamide C00697 Nitrogen C00704 O2.- C01326 Hydrogencyanide C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 71 C00001 H2O C00033 Acetate C00140 N-Acetyl-D-glucosamine C00329 D-Glucosamine C00645 N-Acetyl-D-mannosamine C01674 Chitobiose Consensus scope of cluster 72 C00001 H2O C00507 L-Rhamnose C00861 L-Rhamnulose C02431 L-Rhamnofuranose Consensus scope of cluster 73 C00001 H2O C00479 Propanal C00583 Propane-1,2-diol C02948 4-Hydroxyhexan-3-one Consensus scope of cluster 74 C00001 H2O C00880 D-Galactonate C01216 2-Dehydro-3-deoxy-D-galactonate C03383 D-Galactono-1,4-lactone Consensus scope of cluster 75 C00001 H2O C00141 3-Methyl-2-oxobutanoicacid C04039 2,3-Dihydroxy-3-methylbutanoate C04272 R-2,3-Dihydroxy-3-methylbutanoate Consensus scope of cluster 76 C00001 H2O C02504 2S-2-Isopropylmalate C02631 2-Isopropylmaleate C04411 2R,3S-3-Isopropylmalate Consensus scope of cluster 77 C00001 H2O C04174 trans-2-Decenoyl-acyl-carrierprotein C04180 cis-3-Decenoyl-acyl-carrierprotein C04619 3R-3-Hydroxydecanoyl-acyl-carrierprotein Consensus scope of cluster 78 C00001 H2O C02741 Phosphoribosyl-AMP C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05569 5'-Phospho-D-1-ribulosylformimine Consensus scope of cluster 79 C00001 H2O C02944 3-cis-Dodecenoyl-CoA C03221 2-trans-Dodecenoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA Consensus scope of cluster 80 C00001 H2O C05417 5,6beta-Epoxy-5beta-cholestane C05423 5,6beta-Epoxy-5alpha-cholestane C05424 5alpha-Cholestan-5,6beta-diol Consensus scope of cluster 81 C00001 H2O C01694 Ergosterol C04416 5alpha-Ergosta-7,22-diene-3beta,5-diol C05441 VitaminD2 Consensus scope of cluster 82 C00001 H2O C00033 Acetate C00146 Phenol C00548 Phenylacetate C01866 beta-Lactam C02954 6-Aminopenicillanate C03806 Substitutedbeta-aminoacid C05551 PenicillinG Consensus scope of cluster 83 C00001 H2O C01251 2-Hydroxybutane-1,2,4-tricarboxylate C04002 But-1-ene-1,2,4-tricarboxylate C05662 Homoisocitrate Consensus scope of cluster 84 C00001 H2O C00010 CoA C00827 Lactoyl-CoA C00894 Propenoyl-CoA C01013 3-Hydroxypropanoate C05668 3-Hydroxypropionyl-CoA Consensus scope of cluster 85 C00001 H2O C00011 CO2 C01024 Hydroxymethylbilane C01051 UroporphyrinogenIII C01353 Carbonicacid C03263 CoproporphyrinogenIII C05766 UroporphyrinogenI C05768 CoproporphyrinogenI Consensus scope of cluster 86 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen C05793 L-Urobilin C05794 I-Urobilin C05795 D-Urobilin Consensus scope of cluster 87 C00001 H2O C00116 Glycerol C00969 3-Hydroxypropanal C05999 Lactaldehyde Consensus scope of cluster 88 C00001 H2O C00847 4-Pyridoxate C00971 4-Pyridoxolactone C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate Consensus scope of cluster 89 C00001 H2O C01880 6-Hexanolide C06101 Hexan-1-ol-6-oate C06103 6-Hydroxyhexanoicacid Consensus scope of cluster 90 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00014 NH3 C00027 H2O2 C00080 H+ C00084 Acetaldehyde C00088 Nitrite C00189 Ethanolamine C00192 Hydroxylamine C00244 Nitrate C00266 Glycolaldehyde C00282 Hydrogen C00319 Sphingosine C00346 Ethanolaminephosphate C00517 Hexadecanal C00536 Triphosphate C00697 Nitrogen C00704 O2.- C00836 Sphinganine C01120 Sphinganine1-phosphate C01548 Acetylene C01837 Nitroethane C02466 Trimetaphosphate C03167 Phosphonoacetaldehyde C03557 2-Aminoethylphosphonate C05359 e- C05360 Diimine C05361 Hydrazine C06123 Hexadecenal C06124 Sphingosine1-phosphate C06771 Triethanolamine C06772 Diethanolamine Consensus scope of cluster 91 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06328 6-Chlorobenzene-1,2,4-triol C06329 2-Chloromaleylacetate Consensus scope of cluster 92 C00001 H2O C00011 CO2 C00080 H+ C01353 Carbonicacid C06639 2,2-Bis4'-chlorophenylethanol C06640 Bis4'-chlorophenylacetate C06641 Bis4'-chlorophenylmethane C06642 unsym-Bis4'-chlorophenylethylene Consensus scope of cluster 93 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01327 HCl C02933 3,5-Dichlorocatechol C03918 2,4-Dichloro-cis,cis-muconate C04625 2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06328 6-Chlorobenzene-1,2,4-triol C06329 2-Chloromaleylacetate C07094 3,6-Dichlorocatechol C07095 2,5-Dichloro-cis,cis-muconate C07097 2,6-Dichlorohydroquinone Consensus scope of cluster 94 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05359 e- C07083 Styrene C07111 Ethylbenzene C07112 1-Phenylethanol C11348 S-1-Phenylethanol Consensus scope of cluster 95 C00001 H2O C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene Consensus scope of cluster 96 C00001 H2O C07271 Limonene-1,2-epoxide C07276 Limonene-1,2-diol C11937 1S,4R-1-Hydroxy-2-oxolimonene Consensus scope of cluster 97 C00001 H2O C11945 trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11946 cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11947 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA Consensus scope of cluster 98 C00001 H2O C12107 AHBA C12108 AminoDHS C12109 AminoDHQ Consensus scope of cluster 99 C00001 H2O C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12322 dTDP-L-vancosamine Consensus scope of cluster 100 C00001 H2O C12422 Aklanonicacidmethylester C12423 Aklaviketone C12424 Aklavinone Consensus scope of cluster 101 C00001 H2O C01907 Daunorubicin C12430 13-Dihydrodaunorubicin C12433 13S-13-Dihydrodaunorubicin Consensus scope of cluster 102 C00001 H2O C14101 2-Naphthoicacid C14111 5,6,7,8-Tetrahydro-2-naphthoicacid C14113 Decahydro-2-naphthoicacid Consensus scope of cluster 103 C00001 H2O C00080 H+ C14116 Naphthyl-2-methyl-succinyl-CoA C14117 Naphthyl-2-methylene-succinyl-CoA C14118 Naphthyl-2-hydroxymethyl-succinylCoA C14119 Naphthyl-2-oxomethyl-succinyl-CoA Consensus scope of cluster 104 C00001 H2O C12176 ProansamycinX C12246 ProtorifamycinI C14721 34a-Deoxy-rifamycinW Consensus scope of cluster 105 C00001 H2O C14722 RifamycinW-hemiacetal C14724 Demethyl-desacetyl-rifamycinS C14725 Demethyl-desacetyl-rifamycinSV Consensus scope of cluster 106 C00001 H2O C06314 LipoxinA4 C06315 LipoxinB4 C14815 5,6-Epoxytetraene Consensus scope of cluster 107 C00001 H2O C14840 Bromobenzene-2,3-oxide C14841 2-Bromophenol C14842 Bromobenzene-2,3-dihydrodiol Consensus scope of cluster 108 C00001 H2O C14871 S-Formylmethylglutathione C14874 Glutathioneepisulfoniumion C14875 S-2-Hydroxyethylglutathione Consensus scope of cluster 109 C00001 H2O C08821 Isofucosterol C15782 delta7-Avenasterol C15783 5-Dehydroavenasterol Consensus scope of cluster 110 C00001 H2O C09707 Phaseicacid C15514 8'-Hydroxyabscisate C15971 Dihydrophaseicacid Consensus scope of cluster 111 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C02505 2-Phenylacetamide C05359 e- C05360 Diimine C05361 Hydrazine C07086 Phenylaceticacid C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime Consensus scope of cluster 112 C00001 H2O C00080 H+ C14315 Anthracene C16205 Anthracene-9,10-dihydrodiol C16206 9,10-Dihydroxyanthracene C16207 9,10-Anthraquinone Consensus scope of cluster 113 C00001 H2O C16277 R.g.-KetoI C16279 Thiothece-474 C16280 Okenone Consensus scope of cluster 114 C00001 H2O C02094 beta-Carotene C15943 Isorenieratene C16340 beta-Isorenieratene Consensus scope of cluster 115 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00033 Acetate C00080 H+ C00088 Nitrite C00134 Putrescine C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00555 4-Aminobutanal C00697 Nitrogen C00704 O2.- C02714 N-Acetylputrescine C05359 e- C05360 Diimine C05361 Hydrazine C05936 N4-Acetylaminobutanal C06244 Acetamide C06366 Homospermidine C15668 1-Pyrroline Consensus scope of cluster 116 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00019 S-Adenosyl-L-methionine C00021 S-Adenosyl-L-homocysteine C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00051 Glutathione C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00073 L-Methionine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00088 Nitrite C00090 Catechol C00097 L-Cysteine C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00113 PQQ C00121 D-Ribose C00122 Fumarate C00127 Glutathionedisulfide C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00155 L-Homocysteine C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00170 5'-Methylthioadenosine C00177 Cyanide C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00192 Hydroxylamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00242 Guanine C00244 Nitrate C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00282 Hydrogen C00283 Hydrogensulfide C00288 HCO3- C00292 Aniline C00294 Inosine C00295 Orotate C00296 Quinate C00299 Uridine C00300 Creatine C00302 Glutamate C00309 D-Ribulose C00311 Isocitrate C00315 Spermidine C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00409 Methanethiol C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00441 L-Aspartate4-semialdehyde C00463 Indole C00469 Ethanol C00472 p-Benzoquinone C00475 Cytidine C00483 Tyramine C00488 Formamide C00490 Itaconate C00491 L-Cystine C00493 Shikimate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00519 Hypotaurine C00526 Deoxyuridine C00530 p-Benzenediol C00542 Cystathionine C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00612 N1-Acetylspermidine C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00697 Nitrogen C00704 O2.- C00711 Malate C00716 Serine C00719 Betaine C00736 Cysteine C00740 D-Serine C00745 Nicotine C00750 Spermine C00757 Berberine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00855 D-Methionine C00878 D-Arabinonate C00879 D-Galactarate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00928 Mercaptoethanol C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00957 Mercaptopyruvate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00979 O-Acetyl-L-serine C00986 1,3-Diaminopropane C00993 D-Alanyl-D-alanine C01004 N-Methylnicotinate C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01029 N8-Acetylspermidine C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01077 O-Acetyl-L-homoserine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01137 S-Adenosylmethioninamine C01146 2-Hydroxy-3-oxopropanoate C01152 Npi-Methyl-L-histidine C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01180 4-Methylthio-2-oxobutanoicacid C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01262 beta-Alanyl-Npi-methyl-L-histidine C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01328 HO- C01353 Carbonicacid C01359 PQQH2 C01384 Maleicacid C01401 Alanine C01403 Anisole C01405 Aspirin C01417 Cyanate C01419 Cys-Gly C01420 Cystine C01424 Gallate C01456 Tropate C01468 4-Cresol C01494 Ferulate C01502 o-Methoxyphenol C01537 Urethane C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01667 Bacitracin C01678 Cysteamine C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01752 Scopoletin C01755 Thiocyanate C01762 Xanthosine C01769 S-Acetoin C01795 Columbamine C01817 Homocystine C01837 Nitroethane C01888 Aminoacetone C01962 Thiocysteine C01987 2-Aminophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C02083 Styreneoxide C02091 Ureidoglycine C02105 S-Reticuline C02106 S-Scoulerine C02107 S,S-Tartaricacid C02116 2-Nitropropane C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02222 2-Maleylacetate C02225 2-Methylcitrate C02226 2-Methylmaleate C02235 4-Nitrocatechol C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02291 L-Cystathionine C02294 Methylguanidine C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02372 4-Hydroxyaniline C02442 N-Methyltyramine C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02564 N-Feruloylglycine C02565 N-Methylhydantoin C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02723 N-Methylputrescine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02814 Benzene-1,2,4-triol C02835 Imidazole-4-acetate C02890 Tetrahydropalmatine C02916 S-Norlaudanosoline C02918 1-Methylnicotinamide C02923 2,3-Dihydroxytoluene C02926 2-Aminobutan-4-olide C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02983 L-2-Methyltryptophan C03005 N-Methylanthranilate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03071 3-aci-Nitropropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03089 5-Methylthio-D-ribose C03124 L-Aspartylhydroxamate C03139 N-Amidino-L-aspartate C03145 N-Formyl-L-methionine C03150 N-Ribosylnicotinamide C03172 S-Methyl-L-methionine C03174 S-Succinylglutathione C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03283 L-2,4-Diaminobutanoate C03329 S-Canadine C03340 L-2,3-Dihydrodipicolinate C03354 3-Methylthiopropanamine C03375 Bis3-aminopropylamine C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03431 S-Inosyl-L-homocysteine C03440 cis-4-Hydroxy-D-proline C03451 R-S-Lactoylglutathione C03453 Z-5-Oxohex-2-enedioate C03458 2,3,6-Trihydroxypyridine C03459 2-Hydroxy-3-oxosuccinate C03508 L-2-Amino-3-oxobutanoicacid C03539 S-Ribosyl-L-homocysteine C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03584 3-Uracil-1-yl-L-alanine C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03676 3-Hydroxy-cis,cis-muconate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03914 S-beta-Methylindolepyruvate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C03986 3-Hydroxy-4-methylanthranilate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04118 5,8,13,13a-Tetrahydrocolumbamine C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04322 3,4-Dihydro-2H-Pyrrole-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04431 cis-4-Carboxymethylenebut-2-en-4-olide C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05127 N-Methylhistamine C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05176 S-N-Methylcoclaurine C05202 3'-Hydroxy-N-methyl-S-coclaurine C05239 5-Aminoimidazole C05315 Palmatine C05324 Nicotianamine C05330 Homocysteine C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05359 e- C05360 Diimine C05361 Hydrazine C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05524 Aminoacyl-L-methionine C05527 3-Sulfinylpyruvate C05532 SO2 C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05581 3-Methoxy-4-hydroxyphenylacetaldehyde C05585 Gentisatealdehyde C05587 3-Methoxytyramine C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05640 Cinnavalininate C05644 3-Methylindolepyruvate C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05655 5-2'-Carboxyethyl-4,6-dihydroxypicolinate C05658 Indoxyl C05665 beta-Aminopropionaldehyde C05711 gamma-Glutamyl-beta-cyanoalanine C05714 alpha-Aminopropiononitrile C05715 gamma-Amino-gamma-cyanobutanoate C05717 alpha-Amino-gamma-cyanobutanoate C05730 Glutathionylspermidine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05827 Methylimidazoleacetaldehyde C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05985 2-Propyn-1-al C05986 2-Propyn-1-ol C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06034 4-Hydroxy-4-methylglutamate C06035 4-Methylene-2-oxoglutarate C06114 gamma-Glutamyl-beta-aminopropiononitrile C06144 3-Butynoate C06145 3-Butyn-1-al C06146 3-Butyn-1-ol C06160 S-Norcoclaurine C06161 S-Coclaurine C06178 1-Methylpyrrolinium C06195 Imidazolone C06199 Hordenine C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06213 N-Methyltryptamine C06224 3,4-Dihydroxystyrene C06234 4-Methyl-L-glutamate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06517 S-6-O-Methylnorlaudanosoline C06518 S-Nororientaline C06519 S-3'-Hydroxycoclaurine C06520 S-Norreticuline C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06813 Nitrobenzene C06986 Spirodilactone C07086 Phenylaceticacid C07103 2-Hydroxy-1,4-benzoquinone C07272 Maleimide C07331 Carbonylsulfide C07480 Theobromine C07481 Caffeine C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08276 3-Methylthiopropionicacid C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C09306 Sulfurdioxide C10974 4-Methylaminobutanal C11355 4-Amino-4-deoxychorismate C11500 5'-Dehydroadenosine C11501 9-Riburonosyladenine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11514 E-3-Methoxycarbonylpent-2-enedioate C11515 E-2-Methoxycarbonylmethylbutenedioate C11527 4-Hydroxymandelate C11631 9-Riburonosylhypoxanthine C11821 5-Hydroxyisourate C11838 S-4,5-dihydroxypentan-2,3-dione C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C12838 trans-4-Carboxymethylenebut-2-en-4-olide C13634 2,3-Bis4-hydroxyphenyl-1,2-propanediol C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C13747 1,7-Dimethylxanthine C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14180 S-Hydroxymethylglutathione C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15486 3''-Deamino-3''-oxonicotianamine C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15526 3-Methylhistamine C15599 6-2-Amino-2-carboxyethyl-7,8-dioxo-7,8-dihydroquinoline-2,4-dicarboxylate C15606 1,2-Dihydroxy-5-methylthiopent-1-en-3-one C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C15809 Iminoglycine C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate C16352 7-Methylxanthosine C16353 7-Methylxanthine C16355 7-Methyluricacid C16356 1,7-Dimethyluricacid C16360 3,7-Dimethyluricacid C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea Consensus scope of cluster 117 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00058 Formate C00067 Formaldehyde C00080 H+ C00088 Nitrite C00132 Methanol C00192 Hydroxylamine C00218 Methylamine C00244 Nitrate C00282 Hydrogen C00488 Formamide C00697 Nitrogen C00704 O2.- C01326 Hydrogencyanide C01585 Hexanoicacid C02722 N-Methylhexanamide C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 118 C00001 H2O C00058 Formate C00084 Acetaldehyde C00186 S-Lactate C00256 R-Lactate C01548 Acetylene Consensus scope of cluster 119 C00001 H2O C00259 L-Arabinose C00508 L-Ribulose Consensus scope of cluster 120 C00001 H2O C00148 L-Proline C00763 D-Proline Consensus scope of cluster 121 C00001 H2O C00473 Retinol C00899 11-cis-Retinol Consensus scope of cluster 122 C00001 H2O C00033 Acetate C00315 Spermidine C00612 N1-Acetylspermidine C01029 N8-Acetylspermidine Consensus scope of cluster 123 C00001 H2O C00619 3-Oxo-delta4-steroid C01034 3-Oxo-delta5-steroid Consensus scope of cluster 124 C00001 H2O C00800 L-Gulonate C01040 L-Gulono-1,4-lactone Consensus scope of cluster 125 C00001 H2O C01097 D-Tagatose6-phosphate C01113 D-Galactose6-phosphate Consensus scope of cluster 126 C00001 H2O C00779 Scytalone C01173 1,3,8-Naphthalenertriol Consensus scope of cluster 127 C00001 H2O C00501 CDP-glucose C01219 CDP-4-dehydro-6-deoxy-D-glucose Consensus scope of cluster 128 C00001 H2O C00011 CO2 C01353 Carbonicacid Consensus scope of cluster 129 C00001 H2O C00261 Benzaldehyde C01408 Benzoin Consensus scope of cluster 130 C00001 H2O C00423 trans-Cinnamate C01456 Tropate Consensus scope of cluster 131 C00001 H2O C00312 L-Xylulose C01508 L-Lyxose Consensus scope of cluster 132 C00001 H2O C00084 Acetaldehyde C01548 Acetylene Consensus scope of cluster 133 C00001 H2O C00011 CO2 C01108 1,2,3-Trihydroxybenzene C01353 Carbonicacid C01424 Gallate C01572 Digallate Consensus scope of cluster 134 C00001 H2O C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01717 4-Hydroxy-2-quinolinecarboxylicacid Consensus scope of cluster 135 C00001 H2O C01019 6-Deoxy-L-galactose C01721 L-Fuculose Consensus scope of cluster 136 C00001 H2O C01494 Ferulate C01752 Scopoletin Consensus scope of cluster 137 C00001 H2O C00810 R-Acetoin C01769 S-Acetoin Consensus scope of cluster 138 C00001 H2O C00927 IsonocardicinA C01941 NocardicinA Consensus scope of cluster 139 C00001 H2O C00897 alpha-Maltose C01971 beta-Maltose Consensus scope of cluster 140 C00001 H2O C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00177 Cyanide C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00261 Benzaldehyde C00267 alpha-D-Glucose C00514 D-Mannonate C00561 Mandelonitrile C00794 D-Sorbitol C00817 D-Altronate C00844 R-Prunasin C01083 alpha,alpha-Trehalose C01408 Benzoin C01742 Palatinose C01982 R-Amygdalin C02013 Cellotetraose C02336 beta-D-Fructose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Consensus scope of cluster 141 C00001 H2O C01983 R-Mandelate C01984 S-Mandelate Consensus scope of cluster 142 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00511 Propenoate C00697 Nitrogen C00704 O2.- C01659 Acrylamide C01998 Acrylonitrile C05359 e- C05360 Diimine C05361 Hydrazine Consensus scope of cluster 143 C00001 H2O C00423 trans-Cinnamate C00729 Tropine C01456 Tropate C01479 Atropine C02046 L-Hyoscyamine Consensus scope of cluster 144 C00001 H2O C00601 Phenylacetaldehyde C02083 Styreneoxide Consensus scope of cluster 145 C00001 H2O C01066 Cyclohexane-1,3-dione C02129 5-Oxohexanoicacid Consensus scope of cluster 146 C00001 H2O C01943 Obtusifoliol C02141 Cycloeucalenol Consensus scope of cluster 147 C00001 H2O C00007 Oxygen C00027 H2O2 C00058 Formate C00067 Formaldehyde C00080 H+ C00115 Chloride C00132 Methanol C00704 O2.- C01324 Bromide C01486 Chlorite C02271 Dichloromethane C02661 Bromochloromethane Consensus scope of cluster 148 C00001 H2O C01198 3-2-Hydroxyphenylpropanoate C02274 Dihydrocoumarin Consensus scope of cluster 149 C00001 H2O C01951 Piperitenone C02289 Isopiperitenone Consensus scope of cluster 150 C00001 H2O C00032 Heme C00524 Cytochromec C02248 Apocytochromec C02416 Holocytochromec C05783 Cytochromea C05784 Catalase C05785 Peroxidase Consensus scope of cluster 151 C00001 H2O C02200 UDP-glucosamine C02467 UDP-galactosamine Consensus scope of cluster 152 C00001 H2O C00123 L-Leucine C02486 3R-beta-Leucine Consensus scope of cluster 153 C00001 H2O C01590 Kievitone C02549 Kievitonehydrate Consensus scope of cluster 154 C00001 H2O C01987 2-Aminophenol C02720 N-Hydroxyarylamine Consensus scope of cluster 155 C00001 H2O C01757 Triacetate C02752 Triacetatelactone Consensus scope of cluster 156 C00001 H2O C02037 Glycylglycine C02777 2,5-Dioxopiperazine Consensus scope of cluster 157 C00001 H2O C00011 CO2 C00727 Orcinol C01353 Carbonicacid C01839 Orsellinate C02868 Orsellinatedepside Consensus scope of cluster 158 C00001 H2O C01863 Xanthoaphin C02879 Protoaphinaglucone Consensus scope of cluster 159 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00495 Sulochrin C00704 O2.- C03036 +-Bisdechlorogeodin C03040 --Bisdechlorogeodin Consensus scope of cluster 160 C00001 H2O C01090 16alpha-Hydroxysteroid C03050 16beta-Hydroxysteroid Consensus scope of cluster 161 C00001 H2O C00011 CO2 C00877 Crotonoyl-CoA C01144 S-3-Hydroxybutanoyl-CoA C01353 Carbonicacid C02331 Vinylacetyl-CoA C02411 Glutaconyl-1-CoA C03058 2-Hydroxyglutaryl-CoA C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Consensus scope of cluster 162 C00001 H2O C02660 Benzylthiocyanate C03098 Benzylisothiocyanate Consensus scope of cluster 163 C00001 H2O C00712 9Z-Octadecenoicacid C03195 R-10-Hydroxystearate Consensus scope of cluster 164 C00001 H2O C01126 2-trans,6-trans-Farnesol C03220 2-cis,6-trans-Farnesol Consensus scope of cluster 165 C00001 H2O C03178 Tetrahydroxypteridine C03314 Xanthine-8-carboxylate Consensus scope of cluster 166 C00001 H2O C01157 trans-4-Hydroxy-L-proline C03440 cis-4-Hydroxy-D-proline Consensus scope of cluster 167 C00001 H2O C03319 dTDP-6-deoxy-L-mannose C03442 dTDP-L-dihydrostreptose Consensus scope of cluster 168 C00001 H2O C00249 Hexadecanoicacid C00473 Retinol C00899 11-cis-Retinol C02588 Retinylpalmitate C03455 11-cis-Retinylpalmitate Consensus scope of cluster 169 C00001 H2O C00058 Formate C00080 H+ C00101 Tetrahydrofolate C00234 10-Formyltetrahydrofolate C00445 5,10-Methenyltetrahydrofolate C03479 5-Formyltetrahydrofolate Consensus scope of cluster 170 C00001 H2O C01593 Limonoate C03514 LimonoateD-ring-lactone Consensus scope of cluster 171 C00001 H2O C01110 5-Amino-2-oxopentanoicacid C03564 1-Pyrroline-2-carboxylate Consensus scope of cluster 172 C00001 H2O C01775 Actinomycin C03597 Actinomycinicmonolactone Consensus scope of cluster 173 C00001 H2O C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose Consensus scope of cluster 174 C00001 H2O C01171 alpha-D-Hexose1-phosphate C03735 alpha-D-Hexose6-phosphate Consensus scope of cluster 175 C00001 H2O C03207 16-Dehydroprogesterone C03748 16alpha-Hydroxyprogesterone Consensus scope of cluster 176 C00001 H2O C00059 Sulfate C00329 D-Glucosamine C01075 N-Sulfo-D-glucosamine C03789 N,6-O-Disulfo-D-glucosamine Consensus scope of cluster 177 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01987 2-Aminophenol C02161 Isophenoxazine C02720 N-Hydroxyarylamine C03824 2-Aminomuconatesemialdehyde Consensus scope of cluster 178 C00001 H2O C01720 L-Fuconate C03827 2-Dehydro-3-deoxy-L-fuconate Consensus scope of cluster 179 C00001 H2O C01189 5alpha-Cholest-7-en-3beta-ol C03845 5alpha-Cholest-8-en-3beta-ol Consensus scope of cluster 180 C00001 H2O C01165 L-Glutamate5-semialdehyde C03912 S-1-Pyrroline-5-carboxylate Consensus scope of cluster 181 C00001 H2O C03871 L-2-Amino-6-oxoheptanedioate C03972 2,3,4,5-Tetrahydrodipicolinate Consensus scope of cluster 182 C00001 H2O C01595 Linoleate C04056 9-cis,11-trans-Octadecadienoate Consensus scope of cluster 183 C00001 H2O C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C04076 L-2-Aminoadipate6-semialdehyde Consensus scope of cluster 184 C00001 H2O C03239 6-Amino-2-oxohexanoate C04092 delta1-Piperideine-2-carboxylate Consensus scope of cluster 185 C00001 H2O C03205 11-Deoxycorticosterone C04108 20-Hydroxy-3-oxopregn-4-en-21-al Consensus scope of cluster 186 C00001 H2O C00318 L-Carnitine C04114 4-Trimethylammoniobut-2-enoate Consensus scope of cluster 187 C00001 H2O C04073 Heparosan-N-sulfateL-iduronate C04196 Heparosan-N-sulfateD-glucuronate Consensus scope of cluster 188 C00001 H2O C02027 Deoxylimonate C04251 DeoxylimononicacidD-ring-lactone Consensus scope of cluster 189 C00001 H2O C03356 3-Phospho-D-erythronate C04309 Phosphoenol-4-deoxy-3-tetrulosonate Consensus scope of cluster 190 C00001 H2O C01274 5-Formyl-5,6,7,8-tetrahydromethanopterin C04330 5,10-Methenyltetrahydromethanopterin Consensus scope of cluster 191 C00001 H2O C01711 Inulobiose C04333 Bis-D-fructose2',1:2,1'-dianhydride Consensus scope of cluster 192 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00811 4-Coumarate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01197 3,4-Dihydroxy-trans-cinnamate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C04366 3-2-Carboxyethenyl-cis,cis-muconate C05627 4-Hydroxystyrene C06224 3,4-Dihydroxystyrene Consensus scope of cluster 193 C00001 H2O C02759 alpha-Pinene-oxide C04435 Z-2-Methyl-5-isopropylhexa-2,5-dienal Consensus scope of cluster 194 C00001 H2O C01089 R-3-Hydroxybutanoate C04546 R-3-R-3-Hydroxybutanoyloxybutanoate Consensus scope of cluster 195 C00001 H2O C00451 1R,2S-1-Hydroxypropane-1,2,3-tricarboxylate C04617 1S,2S-1-Hydroxypropane-1,2,3-tricarboxylate Consensus scope of cluster 196 C00001 H2O C04621 E-2-2-Furyl-3-5-nitro-2-furylacrylamide C04622 Z-2-2-Furyl-3-5-nitro-2-furylacrylamide Consensus scope of cluster 197 C00001 H2O C01267 3-Imidazol-4-yl-2-oxopropylphosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate Consensus scope of cluster 198 C00001 H2O C00033 Acetate C01291 3-4-Methylpent-3-en-1-yl-pent-2-enedioyl-CoA C03685 7-Methyl-3-oxooctanoyl-CoA C04675 3-Hydroxy-3-4-methylpent-3-en-1-ylglutaryl-CoA Consensus scope of cluster 199 C00001 H2O C01618 Testolate C04676 Testololactone Consensus scope of cluster 200 C00001 H2O C04685 13E-15S-15-Hydroxy-9-oxoprosta-10,13-dienoate C04686 13E-15S-15-Hydroxy-9-oxoprosta-11,13-dienoate Consensus scope of cluster 201 C00001 H2O C04843 5Z,9E,14Z-8xi,11xi,12S-8,11,12-Trihydroxyicosa-5,9,14-trienoate C04849 5Z,9E,14Z-8xi,11R,12S-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoicacid Consensus scope of cluster 202 C00001 H2O C00059 Sulfate C01310 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine C04864 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine4-sulfate C04865 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine6-sulfate Consensus scope of cluster 203 C00001 H2O C05110 4alpha-Methylcholesta-8-en-3beta-ol C05111 Methostenol Consensus scope of cluster 204 C00001 H2O C04027 delta1-Pyrroline2-carboxylate C05147 trans-L-3-Hydroxyproline Consensus scope of cluster 205 C00001 H2O C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine Consensus scope of cluster 206 C00001 H2O C05229 Phaseollidinhydrate C05230 Phaseollidin Consensus scope of cluster 207 C00001 H2O C05268 S-Hydroxyhexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA Consensus scope of cluster 208 C00001 H2O C05258 S-3-Hydroxyhexadecanoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA Consensus scope of cluster 209 C00001 H2O C05260 S-3-Hydroxytetradecanoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA Consensus scope of cluster 210 C00001 H2O C05264 S-Hydroxydecanoyl-CoA C05275 trans-Dec-2-enoyl-CoA Consensus scope of cluster 211 C00001 H2O C05266 S-Hydroxyoctanoyl-CoA C05276 trans-Oct-2-enoyl-CoA Consensus scope of cluster 212 C00001 H2O C05277 S-3-Hydroxycapryloyl-CoA C05278 R-3-Hydroxycapryloyl-CoA Consensus scope of cluster 213 C00001 H2O C05279 trans,cis-Lauro-2,6-dienoyl-CoA C05280 cis,cis-3,6-Dodecadienoyl-CoA Consensus scope of cluster 214 C00001 H2O C00058 Formate C00951 Estradiol-17beta C05294 19-Hydroxytestosterone C05295 19-Oxotestosterone Consensus scope of cluster 215 C00001 H2O C03198 S-4-Hydroxymandelate C05343 R-4-Hydroxymandelate Consensus scope of cluster 216 C00001 H2O C00011 CO2 C01179 3-4-Hydroxyphenylpyruvate C01353 Carbonicacid C03765 4-Hydroxyphenylacetaldehyde C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate Consensus scope of cluster 217 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00031 D-Glucose C00080 H+ C00088 Nitrite C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00192 Hydroxylamine C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00244 Nitrate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00282 Hydrogen C00329 D-Glucosamine C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00697 Nitrogen C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C03752 2-Amino-2-deoxy-D-gluconate C05359 e- C05360 Diimine C05361 Hydrazine C05383 Aminosugars C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 218 C00001 H2O C00080 H+ C00282 Hydrogen C05359 e- C05413 Phytoene C05414 Phytofluene C05430 zeta-Carotene Consensus scope of cluster 219 C00001 H2O C05437 Zymosterol C05439 5alpha-Cholesta-7,24-dien-3beta-ol Consensus scope of cluster 220 C00001 H2O C01753 Sitosterol C05442 Stigmasterol Consensus scope of cluster 221 C00001 H2O C01164 Cholesta-5,7-dien-3beta-ol C05443 VitaminD3 Consensus scope of cluster 222 C00001 H2O C05447 3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA C05448 3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA Consensus scope of cluster 223 C00001 H2O C05450 3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA C05460 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA Consensus scope of cluster 224 C00001 H2O C00011 CO2 C00487 Carnitine C01353 Carbonicacid C02224 2-Methylcholine C05543 3-Dehydroxycarnitine Consensus scope of cluster 225 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01111 7,8-Dihydroxykynurenate C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate Consensus scope of cluster 226 C00001 H2O C02470 Xanthurenicacid C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate Consensus scope of cluster 227 C00001 H2O C05652 4-2-Amino-5-hydroxyphenyl-2,4-dioxobutanoate C05663 6-Hydroxykynurenate Consensus scope of cluster 228 C00001 H2O C05677 Lipophosphonoglycan C05678 1-Hydroxy-2-aminoethylphosphonate Consensus scope of cluster 229 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00033 Acetate C00227 Acetylphosphate C00536 Triphosphate C02466 Trimetaphosphate C05682 Phosphonoacetate Consensus scope of cluster 230 C00001 H2O C05688 Selenocysteine C05704 Selenocystine Consensus scope of cluster 231 C00001 H2O C05698 Selenohomocysteine C05707 Selenohomocystine Consensus scope of cluster 232 C00001 H2O C00032 Heme C01708 Hemoglobin C05782 Myoglobin C05783 Cytochromea C05784 Catalase C05785 Peroxidase C06258 Globin Consensus scope of cluster 233 C00001 H2O C00080 H+ C05789 L-Urobilinogen C05790 I-Urobilinogen C05791 D-Urobilinogen Consensus scope of cluster 234 C00001 H2O C01328 HO- C02730 2-Succinylbenzoate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C06986 Spirodilactone Consensus scope of cluster 235 C00001 H2O C05838 cis-2-Hydroxycinnamate C05851 Coumarin Consensus scope of cluster 236 C00001 H2O C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C05938 L-4-Hydroxyglutamatesemialdehyde Consensus scope of cluster 237 C00001 H2O C03069 3-Methylcrotonyl-CoA C05998 3-Hydroxyisovaleryl-CoA Consensus scope of cluster 238 C00001 H2O C00011 CO2 C00671 S-3-Methyl-2-oxopentanoicacid C01353 Carbonicacid C02223 2-Methylbutanal C06007 R-2,3-Dihydroxy-3-methylpentanoate Consensus scope of cluster 239 C00001 H2O C04773 3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate C06052 5-Pyridoxolactone Consensus scope of cluster 240 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00169 Carbamoylphosphate C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine C06059 Cyclicamidines C11824 Cyclicamide Consensus scope of cluster 241 C00001 H2O C04718 1,6,6-Trimethyl-2,7-dioxabicyclo3.2.2nonan-3-one C06066 4,5-Dihydro-5,5-dimethyl-4-3-oxobutylfuran-23H-onehexanoate Consensus scope of cluster 242 C00001 H2O C06067 Dimethylallyltryptophan C06068 Elymoclavine Consensus scope of cluster 243 C00001 H2O C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00398 Tryptamine C00514 D-Mannonate C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01742 Palatinose C01852 Secologanin C02013 Cellotetraose C02336 beta-D-Fructose C02964 D-Glucosyl-D-mannose C03309 Strictosidineaglycone C03470 3-alphaS-Strictosidine C03661 1F-beta-D-Fructosylsucrose C06073 Indolealkaloid C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C11678 Dialdehyde Consensus scope of cluster 244 C00001 H2O C06102 Adipatesemialdehyde C06105 Cyclohexan-1,2-dione Consensus scope of cluster 245 C00001 H2O C00011 CO2 C00164 Acetoacetate C00207 Acetone C01353 Carbonicacid C06144 3-Butynoate Consensus scope of cluster 246 C00001 H2O C06171 7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-5_-morphinan-6-one C06172 Neopinone Consensus scope of cluster 247 C00001 H2O C00783 Tropinone C06179 Hygrine Consensus scope of cluster 248 C00001 H2O C02718 N-Formiminoglycine C06195 Imidazolone Consensus scope of cluster 249 C00001 H2O C06390 16-alpha-Hydroxypregnenolone C06392 16,17-Didehydropregnenolone Consensus scope of cluster 250 C00001 H2O C06395 Protein-L-serine C06396 Protein-D-serine Consensus scope of cluster 251 C00001 H2O C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose Consensus scope of cluster 252 C00001 H2O C06399 Hydrogenobyrinate C06408 Precorrin8X Consensus scope of cluster 253 C00001 H2O C00629 2-Dehydro-D-gluconate C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 254 C00001 H2O C06231 Ectoine C06442 N-gamma-Acetyldiaminobutyrate Consensus scope of cluster 255 C00001 H2O C06486 6R-6-L-erythro-1,2-Dihydroxypropyl-5,6,7,8-tetrahydro-4a-hydroxypterin C06487 6R-6-L-erythro-1,2-Dihydroxypropyl-7,8-dihydro-6H-pterin Consensus scope of cluster 256 C00001 H2O C01380 Ethyleneglycol C06548 Ethyleneoxide Consensus scope of cluster 257 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C05556 deltaL-2-Aminoadipyl-L-cysteinyl-D-valine C05557 IsopenicillinN C06564 PenicillinN Consensus scope of cluster 258 C00001 H2O C03206 12-Dehydrotetracycline C06624 Oxytetracycline Consensus scope of cluster 259 C00001 H2O C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06631 dTDP-beta-L-mycarose Consensus scope of cluster 260 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00115 Chloride C00704 O2.- C01486 Chlorite C04596 1,1-Dichloro-2,2-bis4-chlorophenylethylene C06637 1-Chloro-2,2-bis4'-chlorophenylethylene C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate C06646 2-4'-Chlorophenyl-3,3-dichloropropenoate C11353 2-Hydroxy-3-chloropenta-2,4-dienoate Consensus scope of cluster 261 C00001 H2O C00011 CO2 C00115 Chloride C00146 Phenol C00156 4-Hydroxybenzoate C01353 Carbonicacid C02370 4-Chlorobenzoate C06648 4-Chlorobenzaldehyde Consensus scope of cluster 262 C00001 H2O C06661 Clavulanate-9-aldehyde C06662 Clavulanicacid Consensus scope of cluster 263 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C06674 4-Sulfocatechol C06675 3-Sulfomuconate C06676 4-Sulfolactone Consensus scope of cluster 264 C00001 H2O C07090 Protoanemonin C07091 cis-Acetylacrylate Consensus scope of cluster 265 C00001 H2O C07299 Cutin C07300 Cutinmonomer Consensus scope of cluster 266 C00001 H2O C01852 Secologanin C03758 4-2-Aminoethyl-1,2-benzenediol C07304 Deacetylisoipecoside C07307 Deacetylipecoside Consensus scope of cluster 267 C00001 H2O C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone Consensus scope of cluster 268 C00001 H2O C00281 Sedoheptulose7-phosphate C07836 D-glycero-D-manno-Heptose7-phosphate Consensus scope of cluster 269 C00001 H2O C03103 Cyclobutadipyrimidine C08249 Pyrimidine5'-deoxynucleotide Consensus scope of cluster 270 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00509 Naringenin C00704 O2.- C05631 Eriodictyol C06561 Isosalipurpol C06563 Genistein C08576 Aureusidin C08577 Bracteatin C12631 2-Hydroxy-2,3-dihydrogenistein C15525 Eriodictyolchalcone Consensus scope of cluster 271 C00001 H2O C08579 Antheraxanthin C08584 Capsanthin Consensus scope of cluster 272 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01054 S-2,3-Epoxysqualene C01724 Lanosterol C01902 Cycloartenol C06085 Triterpenoid C08615 alpha-Amyrin C08616 beta-Amyrin C08628 Lupeol C08980 SoyasapogenolB C08983 SoyasaponinI C12082 alpha-L-Rhamnopyranosyl-1->2-beta-D-galactopyranosyl-1->2-beta-D-glucuronopyranoside Consensus scope of cluster 273 C00001 H2O C09024 Ajmalicine C09241 Serpentine Consensus scope of cluster 274 C00001 H2O C00766 Flavanone C09321 2'-Hydroxychalcone Consensus scope of cluster 275 C00001 H2O C08578 Butein C09614 Butin Consensus scope of cluster 276 C00001 H2O C01378 Fustin C09736 Fisetinidol-4beta-ol Consensus scope of cluster 277 C00001 H2O C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA Consensus scope of cluster 278 C00001 H2O C01063 6-Carboxyhexanoyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA Consensus scope of cluster 279 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00180 Benzoate C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C05359 e- C05360 Diimine C05361 Hydrazine C09814 Benzonitrile C09815 Benzamide Consensus scope of cluster 280 C00001 H2O C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA Consensus scope of cluster 281 C00001 H2O C01562 Calycosin C10522 Pseudobaptigenin Consensus scope of cluster 282 C00001 H2O C06178 1-Methylpyrrolinium C10974 4-Methylaminobutanal Consensus scope of cluster 283 C00001 H2O C09844 1,8-Cineole C11393 --alpha-Terpineol Consensus scope of cluster 284 C00001 H2O C01767 --Carvone C11395 4R,6R-cis-Carveol Consensus scope of cluster 285 C00001 H2O C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate Consensus scope of cluster 286 C00001 H2O C11383 +-S-Carvone C11408 4S,6S-cis-Carveol Consensus scope of cluster 287 C00001 H2O C11417 3S-6-Hydroxy-3-isopropenyl-heptanoate C11419 3S-3-Isopropenyl-6-oxoheptanoate Consensus scope of cluster 288 C00001 H2O C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol Consensus scope of cluster 289 C00001 H2O C00058 Formate C00571 Cyclohexylamine C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide Consensus scope of cluster 290 C00001 H2O C00009 Orthophosphate C00013 Pyrophosphate C00536 Triphosphate C01204 myo-Inositolhexakisphosphate C02466 Trimetaphosphate C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04579 Inositol1,2,3,4,5-pentakisphosphate C11526 5-PP-InsP5 C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate Consensus scope of cluster 291 C00001 H2O C05773 Cobyrinate C11545 Cobalt-precorrin8 Consensus scope of cluster 292 C00001 H2O C00011 CO2 C00132 Methanol C01353 Carbonicacid C02151 Geissoschizine C11632 Polyneuridinealdehyde C11633 16-Epivellosimine C11634 Vellosimine Consensus scope of cluster 293 C00001 H2O C11633 16-Epivellosimine C11634 Vellosimine Consensus scope of cluster 294 C00001 H2O C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate Consensus scope of cluster 295 C00001 H2O C00080 H+ C01626 Vindoline C03309 Strictosidineaglycone C03677 4,21-Dehydrogeissoschizine C07201 Vinblastine C09107 Catharanthine C09244 Tabersonine C11641 3',4'-Anhydrovinblastine C11678 Dialdehyde C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Consensus scope of cluster 296 C00001 H2O C01512 Loganate C11672 10-Deoxygeniposidicacid Consensus scope of cluster 297 C00001 H2O C04578 16-Methoxy-2,3-dihydro-3-hydroxytabersonine C11675 16-Methoxytabersonine Consensus scope of cluster 298 C00001 H2O C03309 Strictosidineaglycone C11678 Dialdehyde Consensus scope of cluster 299 C00001 H2O C09337 Ankorine C11816 Protoemetine Consensus scope of cluster 300 C00001 H2O C01389 Phytol C02139 Chlorophyllide C05306 Chlorophylla C11850 Divinylchlorophylla Consensus scope of cluster 301 C00001 H2O C06096 GibberellinA29 C11855 GibberellinA29-catabolite Consensus scope of cluster 302 C00001 H2O C11859 GibberellinA37openlactone C11862 GibberellinA36 Consensus scope of cluster 303 C00001 H2O C11854 GibberellinA51-catabolite C11865 GibberellinA51 Consensus scope of cluster 304 C00001 H2O C11863 GibberellinA9 C11866 2,3-Dehydro-gibberellinA9 Consensus scope of cluster 305 C00001 H2O C11864 GibberellinA4 C11867 GibberellinA7 Consensus scope of cluster 306 C00001 H2O C11868 GibberellinA34 C11869 GibberellinA34-catabolite Consensus scope of cluster 307 C00001 H2O C03579 2beta-Hydroxygibberellin1 C11870 GibberellinA8-catabolite Consensus scope of cluster 308 C00001 H2O C02035 GibberellinA20 C11871 GibberellinA5 Consensus scope of cluster 309 C00001 H2O C11884 Neoabietinol C11885 Neoabietal Consensus scope of cluster 310 C00001 H2O C11883 Levopimarinol C11886 Levopimarinal Consensus scope of cluster 311 C00001 H2O C11882 Abietinol C11887 Abietal Consensus scope of cluster 312 C00001 H2O C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose Consensus scope of cluster 313 C00001 H2O C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose Consensus scope of cluster 314 C00001 H2O C11929 Perillyl-CoA C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA Consensus scope of cluster 315 C00001 H2O C11935 4-Isopropenyl-2-oxy-cyclohexanecarboxyl-CoA C11936 3-Isopropenylpimelyl-CoA Consensus scope of cluster 316 C00001 H2O C06428 5Z,8Z,11Z,14Z,17Z-Icosapentaenoicacid C12083 5Z,7E,9E,14Z,17Z-Eicosapentaenoicacid Consensus scope of cluster 317 C00001 H2O C12213 Kanosamine6-phosphate C12214 Aminofructose6-phosphate Consensus scope of cluster 318 C00001 H2O C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate Consensus scope of cluster 319 C00001 H2O C12366 TetracenomycinF2 C12367 TetracenomycinF1 Consensus scope of cluster 320 C00001 H2O C12396 Tetrangomycin C12397 Tetrangulol Consensus scope of cluster 321 C00001 H2O C12410 UrdamycinoneF C12412 Aquayamycin Consensus scope of cluster 322 C00001 H2O C12431 13-Dihydrocarminomycin C12432 Carminomycin Consensus scope of cluster 323 C00001 H2O C12434 S-DNPA C12435 5-Deoxodihydrokalafungin Consensus scope of cluster 324 C00001 H2O C12436 Dihydrokalafungin C12437 Medermycin Consensus scope of cluster 325 C00001 H2O C10858 Ecgonine C12449 Pseudoecgonine Consensus scope of cluster 326 C00001 H2O C06181 Piperideine C12455 5-Aminopentanal Consensus scope of cluster 327 C00001 H2O C12834 2,5-Dichloro-carboxymethylenebut-2-en-4-olide C12835 2,5-Dichloro-4-oxohex-2-enedioate Consensus scope of cluster 328 C00001 H2O C06082 Abscisate C13454 Xanthoxicacid Consensus scope of cluster 329 C00001 H2O C13455 Abscisicaldehyde C13456 Abscisicalcohol Consensus scope of cluster 330 C00001 H2O C13626 5-HydroxybisphenolA C13628 4,5-Bisphenol-o-quinone Consensus scope of cluster 331 C00001 H2O C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene Consensus scope of cluster 332 C00001 H2O C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene Consensus scope of cluster 333 C00001 H2O C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA Consensus scope of cluster 334 C00001 H2O C06006 S-2-Aceto-2-hydroxybutanoate C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate Consensus scope of cluster 335 C00001 H2O C12044 Rifamycin C14540 RifamycinS Consensus scope of cluster 336 C00001 H2O C14602 3-Hydroxyaminophenol C14604 Aminohydroquinone Consensus scope of cluster 337 C00001 H2O C12247 RifamycinW C14723 RifamycinZ Consensus scope of cluster 338 C00001 H2O C14768 5,6-EET C14772 5,6-DHET Consensus scope of cluster 339 C00001 H2O C14769 8,9-EET C14773 8,9-DHET Consensus scope of cluster 340 C00001 H2O C14770 11,12-EET C14774 11,12-DHET Consensus scope of cluster 341 C00001 H2O C14771 14,15-EET C14775 14,15-DHET Consensus scope of cluster 342 C00001 H2O C03012 Naphthalene-1,2-diol C14783 1,2-Naphthoquinone Consensus scope of cluster 343 C00001 H2O C02617 1,4-Naphthoquinone C14785 1,4-Dihydroxynaphthalene Consensus scope of cluster 344 C00001 H2O C14788 1-Nitrosonaphthalene C14789 N-Hydroxy-1-aminonaphthalene Consensus scope of cluster 345 C00001 H2O C14800 1-Nitronaphthalene-5,6-oxide C14801 1-Nitro-5,6-dihydroxy-dihydronaphthalene Consensus scope of cluster 346 C00001 H2O C14825 910-EpOME C14828 9,10-DHOME Consensus scope of cluster 347 C00001 H2O C14826 1213-EpOME C14829 12,13-DHOME Consensus scope of cluster 348 C00001 H2O C14556 9-Hydroxybenzoapyrene C14849 Benzoapyrene-9,10-oxide Consensus scope of cluster 349 C00001 H2O C14850 Benzoapyrene-7,8-oxide C14852 Benzoapyrene-7,8-diol Consensus scope of cluster 350 C00001 H2O C14858 2,2-Dichloroacetaldehyde C14860 2,2-Dichloro-1,1-ethanediol Consensus scope of cluster 351 C00001 H2O C06899 Chloralhydrate C14866 Chloral Consensus scope of cluster 352 C00001 H2O C11148 TCEepoxide C14867 Dichloroacetylchloride Consensus scope of cluster 353 C00001 H2O C05631 Eriodictyol C15525 Eriodictyolchalcone Consensus scope of cluster 354 C00001 H2O C00010 CoA C03160 2-Succinylbenzoyl-CoA C03657 1,4-Dihydroxy-2-naphthoate C06986 Spirodilactone C15547 1,4-Dihydroxy-2-naphthoyl-CoA Consensus scope of cluster 355 C00001 H2O C15568 7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate C15569 12alpha-Hydroxy-3-oxochola-4,6-dienoate Consensus scope of cluster 356 C00001 H2O C00011 CO2 C01353 Carbonicacid C03373 Aminoimidazoleribotide C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole Consensus scope of cluster 357 C00001 H2O C00555 4-Aminobutanal C15668 1-Pyrroline Consensus scope of cluster 358 C00001 H2O C11522 24-Methylenelophenol C15776 4alpha-Methylfecosterol Consensus scope of cluster 359 C00001 H2O C01789 Campesterol C15784 Campest-4-en-3beta-ol Consensus scope of cluster 360 C00001 H2O C15786 5alpha-Campestan-3-one C15787 Campestanol Consensus scope of cluster 361 C00001 H2O C15788 6alpha-Hydroxycampestanol C15789 6-Oxocampestanol Consensus scope of cluster 362 C00001 H2O C15795 22alpha-Hydroxy-campesterol C15796 22alpha-Hydroxy-campest-4-en-3-one Consensus scope of cluster 363 C00001 H2O C15797 22alpha-Hydroxy-5alpha-campestan-3-one C15798 6-Deoxocathasterone Consensus scope of cluster 364 C00001 H2O C02646 4-Coumarylalcohol C15804 p-Hydroxyphenyllignin Consensus scope of cluster 365 C00001 H2O C00590 Coniferylalcohol C15805 Guaiacyllignin Consensus scope of cluster 366 C00001 H2O C02325 Sinapylalcohol C15806 Syringyllignin Consensus scope of cluster 367 C00001 H2O C12205 5-Hydroxyconiferylalcohol C15807 5-Hydroxy-guaiacyllignin Consensus scope of cluster 368 C00001 H2O C00037 Glycine C15809 Iminoglycine Consensus scope of cluster 369 C00001 H2O C15812 C15812 C15813 C15813 C15814 C15814 C15815 C15815 Consensus scope of cluster 370 C00001 H2O C00080 H+ C00282 Hydrogen C05359 e- C15877 Anhydrorhodovibrin C15878 Rhodovibrin C15879 Hydroxyspirilloxanthin Consensus scope of cluster 371 C00001 H2O C14151 delta-Tocopherol C15882 2-Methyl-6-phytylquinol Consensus scope of cluster 372 C00001 H2O C02483 gamma-Tocopherol C15883 2,3-Dimethyl-5-phytylquinol Consensus scope of cluster 373 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15881 Spirilloxanthin C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin Consensus scope of cluster 374 C00001 H2O C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin Consensus scope of cluster 375 C00001 H2O C15900 Spheroidene C15902 Hydroxyspheroidene Consensus scope of cluster 376 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C15900 Spheroidene C15902 Hydroxyspheroidene C15903 Spheroidenone C15905 Hydroxyspheroidenone Consensus scope of cluster 377 C00001 H2O C01115 L-Galactono-1,4-lactone C15930 L-Galactonate Consensus scope of cluster 378 C00001 H2O C15928 4-Ketomyxol C15932 4-Hydroxymyxol Consensus scope of cluster 379 C00001 H2O C16014 cis-Stilbeneoxide C16015 +-1R,2R-1,2-Diphenylethane-1,2-diol Consensus scope of cluster 380 C00001 H2O C16144 Dehydrosqualene C16145 4,4'-Diaponeurosporene Consensus scope of cluster 381 C00001 H2O C14899 3-Dehydro-L-gulonate6-phosphate C16186 L-Ascorbate6-phosphate Consensus scope of cluster 382 C00001 H2O C16188 7-Hydroxy-2',4',5'-trimethoxyisoflavone C16189 9-Demethylmunduserone Consensus scope of cluster 383 C00001 H2O C00858 Formononetin C16190 2,7-Dihydroxy-4'-methoxyisoflavanone Consensus scope of cluster 384 C00001 H2O C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA Consensus scope of cluster 385 C00001 H2O C14314 4',6,7-Trihydroxyisoflavone C16233 2,6,7,4'-Tetrahydroxyisoflavanone Consensus scope of cluster 386 C00001 H2O C00011 CO2 C00632 3-Hydroxyanthranilate C01353 Carbonicacid C01987 2-Aminophenol C02720 N-Hydroxyarylamine C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 387 C00001 H2O C00007 Oxygen C00014 NH3 C00027 H2O2 C00080 H+ C00088 Nitrite C00192 Hydroxylamine C00244 Nitrate C00282 Hydrogen C00697 Nitrogen C00704 O2.- C03925 3,5-Dibromo-4-hydroxybenzoate C04178 3,5-Dibromo-4-hydroxybenzonitrile C05359 e- C05360 Diimine C05361 Hydrazine C16246 3,5-Dibromo-4-hydroxybenzamide Consensus scope of cluster 388 C00001 H2O C06719 Dihydrophloroglucinol C16272 3-Hydroxy-5-oxohexanoate Consensus scope of cluster 389 C00001 H2O C05434 beta-Zeacarotene C16291 7,8-Dihydro-beta-carotene Consensus scope of cluster 390 C00001 H2O C16309 Traumatin C16311 12-Oxo-9Z-dodecenoicacid Consensus scope of cluster 391 C00001 H2O C16328 trans-2-Enoyl-OPC8-CoA C16329 3-Hydroxy-OPC8-CoA Consensus scope of cluster 392 C00001 H2O C16332 trans-2-Enoyl-OPC6-CoA C16333 3-Hydroxy-OPC6-CoA Consensus scope of cluster 393 C00001 H2O C16336 trans-2-Enoyl-OPC4-CoA C16337 3-Hydroxy-OPC4-CoA Consensus scope of cluster 394 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate C07481 Caffeine C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin C16363 N-Methylurea C16364 N,N'-Dimethylurea Consensus scope of cluster 395 C00001 H2O C16374 2E,6Z,9Z,12Z,15Z,18Z,21Z-Tetracosahepta-2,6,9,12,15,18,21-enoyl-CoA C16375 6Z,9Z,12Z,15Z,18Z,21Z-3-Hydroxytetracosahexa-6,9,12,15,18,21-enoyl-CoA Consensus scope of cluster 396 C00001 H2O C16387 2E,6Z,9Z,12Z,15Z,18Z-Tetracosahexa-2,6,9,12,15,18-enoyl-CoA C16388 6Z,9Z,12Z,15Z,18Z-3-Hydroxytetracosapenta-6,9,12,15,18-enoyl-CoA Consensus scope of cluster 397 C00001 H2O C09827 Pinocembrin C16404 Pinocembrinchalcone Consensus scope of cluster 398 C00001 H2O C09756 Homoeriodictyol C16405 Homoeriodictyolchalcone Consensus scope of cluster 399 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C16407 2',4,4',6'-Tetrahydroxychalcone4'-O-glucoside C16408 2',3,4,4',6'-Peptahydroxychalcone4'-O-glucoside C16409 Aureusidin6-O-glucoside C16410 Bracteatin6-O-glucoside Consensus scope of cluster 400 C00001 H2O C16402 2,4-Dihydroxylamino-6-nitrotoluene C16414 2-Amino-5-hydroxyl-4-hydroxylamino-6-nitrotoluene Consensus scope of cluster 401 C00001 H2O C09751 Garbanzol C16415 5-Deoxyleucopelargonidin Consensus scope of cluster 402 C00001 H2O C09789 Naringin C16423 Naringinchalcone datasetS2/semiStrict_no_o2/hierarchical_clusters.txt0000644000175000017500000017120010747436025022630 0ustar oliveroliverMetabolites in cluster 1: C00021 S-Adenosyl-L-homocysteine C00025 L-Glutamate C00049 L-Aspartate C00051 Glutathione C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00073 L-Methionine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00082 L-Tyrosine C00086 Urea C00097 L-Cysteine C00108 Anthranilate C00113 PQQ C00127 Glutathionedisulfide C00135 L-Histidine C00147 Adenine C00152 L-Asparagine C00155 L-Homocysteine C00179 Agmatine C00188 L-Threonine C00212 Adenosine C00217 D-Glutamate C00242 Guanine C00270 N-Acetylneuraminate C00300 Creatine C00327 L-Citrulline C00328 L-Kynurenine C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00402 D-Aspartate C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00475 Cytidine C00491 L-Cystine C00499 Allantoate C00506 L-Cysteate C00515 D-Ornithine C00542 Cystathionine C00568 4-Aminobenzoate C00581 Guanidinoacetate C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00669 gamma-L-Glutamyl-L-cysteine C00716 Serine C00740 D-Serine C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00813 Barbiturate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00855 D-Methionine C00884 Homocarnosine C00906 5,6-Dihydrothymine C00921 Dihydropteroate C00931 Porphobilinogen C00940 2-Oxoglutaramate C00977 L-Tryptophanamide C01010 Urea-1-carboxylate C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01047 N5-Ethyl-L-glutamine C01118 O-Succinyl-L-homoserine C01162 3-Pyrazol-1-yl-L-alanine C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01417 Cyanate C01419 Cys-Gly C01537 Urethane C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01596 Maleamate C01667 Bacitracin C01762 Xanthosine C01993 5'-Oxoinosine C02091 Ureidoglycine C02166 LeukotrieneC4 C02218 2-Aminoacrylate C02220 2-Aminomuconate C02237 5-Oxo-D-proline C02253 Benzoylagmatine C02291 L-Cystathionine C02294 Methylguanidine C02348 R--Allantoin C02350 S+-Allantoin C02362 2-Oxosuccinamate C02512 3-Cyano-L-alanine C02634 3-Chloro-D-alanine C02635 3-Chloro-L-alanine C02642 3-Ureidopropionate C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02727 N6-Acetyl-L-lysine C02775 2,3-Dihydroxyindole C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C03015 O-Carbamoyl-L-serine C03047 1,4-Diguanidinobutane C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03139 N-Amidino-L-aspartate C03145 N-Formyl-L-methionine C03174 S-Succinylglutathione C03227 3-Hydroxy-L-kynurenine C03283 L-2,4-Diaminobutanoate C03296 N2-Succinyl-L-arginine C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03451 R-S-Lactoylglutathione C03539 S-Ribosyl-L-homocysteine C03574 2-Formylaminobenzaldehyde C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03626 NG,NG-Dimethyl-L-arginine C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03722 Pyridine-2,3-dicarboxylate C03741 S-4-Amino-5-oxopentanoate C03771 5-Guanidino-2-oxopentanoate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C04075 L-2-Amino-4-chloropent-4-enoate C04079 N-R-Pantothenoyl-L-cysteine C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04409 2-Amino-3-carboxymuconatesemialdehyde C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04690 2-Hydroxymethyl-3-acetamidomethylenesuccinate C04771 S-2-Amino-3-3-hydroxy-4-oxo-4H-pyridin-1-ylpropanoate C04776 D-Galactosyl-3-N-acetyl-beta-D-galactosaminyl-L-serine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05100 3-Ureidoisobutyrate C05133 4-Imidazolone-5-acetate C05281 5-Methylbarbiturate C05335 Selenomethionine C05341 beta-Alanyl-L-lysine C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05524 Aminoacyl-L-methionine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05573 Formylisoglutamate C05574 Isoglutamate C05575 Hercynine C05648 5-Hydroxy-N-formylkynurenine C05653 Formylanthranilate C05658 Indoxyl C05692 Se-Adenosylselenohomocysteine C05699 Selenocystathionine C05711 gamma-Glutamyl-beta-cyanoalanine C05730 Glutathionylspermidine C05829 N-Carbamyl-L-glutamate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05939 Linatine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C06034 4-Hydroxy-4-methylglutamate C06234 4-Methyl-L-glutamate C06381 Methylenediurea C06382 N-Carboxyaminomethylurea C06393 2,3-Diaminopropanoate C06462 LeukotrieneF4 C06551 Atrazine C06552 Hydroxyatrazine C06553 N-Isopropylammelide C06554 Cyanuricacid C06555 Biuret C06556 Deisopropylatrazine C06557 Deisopropylhydroxyatrazine C06558 2,4-Dihydroxy-6-N'-ethylamino-1,3,5-triazine C06560 Deisopropyldeethylatrazine C06657 Guanidinoproclavaminicacid C07272 Maleimide C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08735 2-Chloro-4-hydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11511 threo-3-Hydroxy-L-aspartate C11631 9-Riburonosylhypoxanthine C12989 N2-Acetyl-L-lysine C14147 Cyromazine C14148 N-Cyclopropylammeline C14149 N-Cyclopropylammelide C14180 S-Hydroxymethylglutathione C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14803 1-Nitro-7-hydroxy-8-glutathionyl-7,8-dihydronaphthalene C14804 1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene C14805 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene C14806 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalene C14847 3,4-Dihydro-3-hydroxy-4-S-glutathionylbromobenzene C14848 2,3-Dihydro-2-S-glutathionyl-3-hydroxybromobenzene C14855 4,5-Dihydro-4-hydroxy-5-S-glutathionyl-benzoapyrene C14856 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzoapyrene C14861 S-2,2-Dichloro-1-hydroxyethylglutathione C14863 2-S-Glutathionylacetylglutathione C15607 3-Oxo-3-ureidopropanoate C15767 gamma-Glutamyl-gamma-aminobutyraye Metabolites in cluster 2: C00022 Pyruvate C00036 Oxaloacetate C00158 Citrate C00166 Phenylpyruvate C00222 3-Oxopropanoate C00251 Chorismate C00254 Prephenate C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00502 D-Xylonate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00804 Propynoate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00922 2,3-Dimethylmaleate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01163 3-Carboxy-cis,cis-muconate C01187 3-Deoxy-D-manno-octulosonate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01680 D-Fuconate C01732 Mesaconate C01934 L-Rhamnonate C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02295 Methylitaconate C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02930 2-Methyleneglutarate C02991 L-Rhamnono-1,4-lactone C03063 2-Oxohept-3-enedioate C03248 Acetylenedicarboxylate C03340 L-2,3-Dihydrodipicolinate C03453 Z-5-Oxohex-2-enedioate C03548 trans-2,3-Epoxysuccinate C03572 2-Chloro-cis,cis-muconate C03585 3-Chloro-cis,cis-muconate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04522 2-Chloro-2,5-dihydro-5-oxofuran-2-acetate C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05406 4S-5-Hydroxy-2,4-dioxopentanoate C05527 3-Sulfinylpyruvate C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06159 2-Dehydro-3-deoxy-D-fuconate C06201 2,4-Dihydroxyhept-2-enedioate C06203 trans-O-Hydroxybenzylidenepyruvate C06204 2-Hydroxychromene-2-carboxylate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06581 2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate C06582 2-Hydroxy-6-oxo-7-methylocta-2,4-dienoate C06587 2-Hydroxy-6-oxo-6-4'-chlorophenyl-hexa-2,4-dienoate C06609 trans-1,3-Dichloropropene C06610 cis-1,3-Dichloropropene C06611 trans-3-Chloro-2-propene-1-ol C06612 cis-3-Chloro-2-propene-1-ol C06613 3-Chloroallylaldehyde C06614 trans-3-Chloroacrylicacid C06615 cis-3-Chloroacrylicacid C06711 Fluoren-9-ol C06744 3-Deoxyoctulosonyl-lipopolysaccharide C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07089 5-Chloro-2-hydroxymuconicsemialdehyde C07102 5-Chloro-1,2,4-trihydroxybenzene C07123 2-Hydroxy-6-oxo-octa-2,4-dienoate C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11354 2-Hydroxy-cis-hex-2,4-dienoate C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C12624 2-Hydroxy-6-ketononatrienedioate C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14106 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate C14107 2-Hydroxy-4-hydroxymethylbenzalpyruvate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16069 3-Sulfolactate C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16209 3-2-Carboxyvinylnaphthalene-2-carboxylicacid C16210 4-3-Hydroxy-2-naphthyl-2-oxobut-3-enoicacid C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16266 3-Chloro-2-hydroxymuconicsemialdehyde C16348 cis-3-Chloroallylaldehyde C16390 S-2-Hydroxymethylglutarate Metabolites in cluster 3: C00002 ATP C00003 NAD+ C00006 NADP+ C00008 ADP C00015 UDP C00016 FAD C00020 AMP C00029 UDP-glucose C00035 GDP C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00063 CTP C00075 UTP C00081 ITP C00096 GDP-mannose C00104 IDP C00105 UMP C00112 CDP C00128 CMP-N-acetylneuraminate C00130 IMP C00144 GMP C00167 UDP-glucuronate C00190 UDP-D-xylose C00203 UDP-N-acetyl-D-galactosamine C00239 dCMP C00286 dGTP C00301 ADP-ribose C00360 dAMP C00362 dGMP C00365 dUMP C00394 GDP-glucose C00458 dCTP C00460 dUTP C00498 ADP-glucose C00513 CDP-glycerol C00575 3',5'-CyclicAMP C00617 UDP-D-galacturonate C00655 Xanthosine5'-phosphate C00700 XTP C00705 dCDP C00857 Deamino-NAD+ C00935 UDP-L-arabinose C00942 3',5'-CyclicGMP C01005 O-Phospho-L-serine C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01201 Nomega-ADP-D-ribosyl-L-arginine C01222 GDP-4-dehydro-6-deoxy-D-mannose C01228 Guanosine3',5'-bisdiphosphate C01233 sn-glycero-3-Phosphoethanolamine C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01299 Adenylyl-L-glutamate:ammonialigaseADP-forming C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01367 3'-AMP C01368 3'-UMP C02280 GDP-L-galactose C02305 Phosphocreatine C02330 UDP-L-iduronate C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02532 D-O-Phosphoserine C02739 Phosphoribosyl-ATP C03483 Adenosinetetraphosphate C03506 Indoleglycerolphosphate C03614 Inosine5'-tetraphosphate C03691 CMP-N-glycoloylneuraminate C03733 UDP-alpha-D-galacto-1,4-furanose C03794 N6-1,2-Dicarboxyethyl-AMP C03872 L-Serine-phosphoethanolamine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04494 Guanosine3'-diphosphate5'-triphosphate C04652 UDP-2,3-bis3-hydroxytetradecanoylglucosamine C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C05005 Glycolipid C05114 Mucopolysaccharide C05227 UDP-sugar C05822 3'-CMP C05922 Formamidopyrimidinenucleosidetriphosphate C05993 Acetyladenylate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06241 N-Acetylneuraminate9-phosphate C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C14830 GDP-4-keto-6-L-deoxygalactose C15925 GDP-L-gulose Metabolites in cluster 4: C00085 D-Fructose6-phosphate C00092 D-Glucose6-phosphate C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00199 D-Ribulose5-phosphate C00231 D-Xylulose5-phosphate C00275 D-Mannose6-phosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00357 N-Acetyl-D-glucosamine6-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00620 alpha-D-Ribose1-phosphate C00636 D-Mannose1-phosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C01094 D-Fructose1-phosphate C01099 L-Fuculose1-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01131 L-Rhamnulose1-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01185 NicotinateD-ribonucleotide C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C02591 Sucrose6-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03394 Erythrulose1-phosphate C03536 Pyrimidine5'-nucleotide C03546 myo-Inositol4-phosphate C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04645 6-D-Glucose-1-phospho-D-mannosylglycoprotein C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05396 Lactose6-phosphate C06019 D-arabino-3-Hexulose6-phosphate C06156 alpha-D-Glucosamine1-phosphate C06187 Arbutin6-phosphate C06188 Salicin6-phosphate C06441 L-Xylulose1-phosphate C15585 myo-Inositolphosphate Metabolites in cluster 5: C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00267 alpha-D-Glucose C00464 Mannan C00761 Coniferin C01083 alpha,alpha-Trehalose C01158 1-O-Galloyl-beta-D-glucose C01533 Syringin C01742 Palatinose C02013 Cellotetraose C02074 Raucaffricine C02655 6-Acetyl-D-glucose C02827 D-Glucose6-sulfate C02964 D-Glucosyl-D-mannose C03855 Cholesteryl-beta-D-glucoside C03915 1-O-Sinapoylbeta-D-glucoside C04218 alpha,alpha'-Trehalose6-mycolate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05403 3-Ketolactose C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C06046 Salidroside C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose Metabolites in cluster 6: C00074 Phosphoenolpyruvate C00197 3-Phospho-D-glycerate C00236 3-Phospho-D-glyceroylphosphate C00345 6-Phospho-D-gluconate C00363 dTDP C00364 dTMP C00459 dTTP C00631 2-Phospho-D-glycerate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C01159 2,3-Bisphospho-D-glycerate C01236 D-Glucono-1,5-lactone6-phosphate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C02798 3-Phosphonopyruvate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C11536 2R-O-Phospho-3-sulfolactate C12106 AminoDAHP Metabolites in cluster 7: C00909 LeukotrieneA4 C02165 LeukotrieneB4 C04822 8R-HPETE C05356 5S-HPETE C05956 ProstaglandinG2 C05965 12S-HPETE C05966 15S-HPETE C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Metabolites in cluster 8: C05421 15-cis-Phytoene C05431 Neurosporene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C14146 alpha-Zeacarotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15860 1'-Hydroxytorulene C15870 Rhodopin C15892 Chloroxanthin C15907 1',2'-Dihydro-gamma-carotene C15908 Chlorobactene C15910 1',2'-Dihydrochlorobactene C15911 Hydroxychlorobactene C16276 epsilon-Carotene Metabolites in cluster 9: C00014 NH3 C00088 Nitrite C00153 Nicotinamide C00192 Hydroxylamine C00559 Deoxyadenosine C00715 Pterin C00835 Sepiapterin C00881 Deoxycytidine C00990 5-Aminopentanamide C01109 4-Methylene-L-glutamine C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01526 Ricinine C01842 Pentanamide C05360 Diimine C05361 Hydrazine Metabolites in cluster 10: C00024 Acetyl-CoA C00083 Malonyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00406 Feruloyl-CoA C00531 Itaconyl-CoA C00566 3S-Citryl-CoA C00904 Citramalyl-CoA C01011 3S-Citramalyl-CoA C03231 3-Methylglutaconyl-CoA C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA Metabolites in cluster 11: C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C06620 dTDP-3,4-dioxo-2,6-dideoxy-D-glucose C06621 dTDP-4-oxo-2,6-dideoxy-alpha-D-glucose C06622 dTDP-4-oxo-2,6-dideoxy-L-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11912 dTDP-6-deoxy-D-allose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11932 dTDP1-esterwith2,6-dideoxy-L-erythro-hexopyranos-3-ulose Metabolites in cluster 12: C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C01312 ProstaglandinI2 C02198 ThromboxaneA2 C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C14717 15-Deoxy-delta-12,14-PGJ2 Metabolites in cluster 13: C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C03190 +-Bornyl-diphosphate C03427 Prephytoenediphosphate C06076 Comphene C06089 ent-Copalyldiphosphate C06111 Nerolidyldiphosphate C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate Metabolites in cluster 14: C00047 L-Lysine C00666 LL-2,6-Diaminoheptanedioate C00680 meso-2,6-Diaminoheptanedioate C00739 D-Lysine C01142 3S-3,6-Diaminohexanoate C01186 3S,5S-3,5-Diaminohexanoate C02837 L-Lysine1,6-lactam C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C05161 2,5-Diaminohexanoate C05328 D-2-Amino-hexano-6-lactam C05552 N6-D-Biotinyl-L-lysine Metabolites in cluster 15: C00053 3'-Phosphoadenylylsulfate C00068 Thiamindiphosphate C00224 Adenylylsulfate C00882 Dephospho-CoA C01081 Thiaminmonophosphate C03028 Thiamintriphosphate C04327 4-Methyl-5-2-phosphoethyl-thiazole C05125 2-alpha-Hydroxyethylthiaminediphosphate C11521 UDP-6-sulfoquinovose Metabolites in cluster 16: C15791 Teasterone C15792 3-Dehydroteasterone C15793 Typhasterol C15794 Castasterone C15799 6-Deoxoteasterone C15800 3-Dehydro-6-deoxoteasterone C15801 6-Deoxotyphasterol C15802 6-Deoxocastasterone C15803 6alpha-Hydroxy-castasterone Metabolites in cluster 17: C01226 12-OPDA C04594 9Z-13S-12,13-Epoxyoctadeca-9,11-dienoicacid C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16324 9,10-EOT C16325 10-OPDA Metabolites in cluster 18: C03677 4,21-Dehydrogeissoschizine C09107 Catharanthine C09244 Tabersonine C11679 4,21-Dehydrocorynantheinealdehyde C11680 Cathenamine C11681 19-epi-Cathenamine C11691 Stemmadenine C11783 Minovincinine Metabolites in cluster 19: C00472 p-Benzoquinone C02222 2-Maleylacetate C02814 Benzene-1,2,4-triol C03676 3-Hydroxy-cis,cis-muconate C04431 cis-4-Carboxymethylenebut-2-en-4-olide C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07103 2-Hydroxy-1,4-benzoquinone C12838 trans-4-Carboxymethylenebut-2-en-4-olide Metabolites in cluster 20: C01054 S-2,3-Epoxysqualene C01724 Lanosterol C01902 Cycloartenol C06085 Triterpenoid C08615 alpha-Amyrin C08616 beta-Amyrin C08628 Lupeol Metabolites in cluster 21: C00877 Crotonoyl-CoA C01144 S-3-Hydroxybutanoyl-CoA C02331 Vinylacetyl-CoA C03561 R-3-Hydroxybutanoyl-CoA C05116 3-Hydroxybutanoyl-CoA C11062 4-Hydroxybutyryl-CoA C16268 Cyclopropanecarboxyl-CoA Metabolites in cluster 22: C00196 2,3-Dihydroxybenzoate C00230 3,4-Dihydroxybenzoate C00944 3-Dehydroquinate C02637 3-Dehydroshikimate C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate Metabolites in cluster 23: C00243 Lactose C00492 Raffinose C01613 Stachyose C05400 Epimelibiose C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose Metabolites in cluster 24: C00072 Ascorbate C00425 Dehydroascorbate C01041 Monodehydroascorbate C03289 L-xylo-Hexulonolactone C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05422 L-Dehydroascorbate Metabolites in cluster 25: C11396 1R,2R,4R-Dihydrocarveol C11397 1R,2S,4R-Neo-dihydrocarveol C11398 1R,4R-Dihydrocarvone C11399 1S,2S,4R-Iso-dihydrocarveol C11400 1S,2R,4R-Neoiso-dihydrocarveol C11401 1S,4R-Iso-dihydrocarvone Metabolites in cluster 26: C11410 1R,2S,4S-Neoiso-dihydrocarveol C11411 1R,2R,4S-Iso-dihydrocarveol C11412 1R,4S-Iso-dihydrocarvone C11413 1S,2S,4S-Dihydrocarveol C11415 1S,4S-Dihydrocarvone C11416 1S,2R,4S-Neo-dihydrocarveol Metabolites in cluster 27: C14453 4-Bromophenol C14839 Bromobenzene-3,4-oxide C14843 4-Bromocatechol C14844 Bromobenzene-3,4-dihydrodiol C14845 4-Bromophenol-2,3-epoxide C14846 4-Bromo-3,5-cyclohexadiene-1,2-dione Metabolites in cluster 28: C01693 L-Dopachrome C04185 5,6-Dihydroxyindole-2-carboxylate C05579 Indole-5,6-quinone C05604 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole C05606 Melanin C15566 D-Dopachrome Metabolites in cluster 29: C08650 Isoliquiritigenin C09762 Liquiritigenin C10200 Anhydroglycinol C10208 Daidzein C12123 7,4'-Dihydroxyflavone C15567 2,7,4'-Trihydroxyisoflavanone Metabolites in cluster 30: C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00257 D-Gluconicacid C00514 D-Mannonate C00817 D-Altronate Metabolites in cluster 31: C00048 Glyoxylate C00168 Hydroxypyruvate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C03459 2-Hydroxy-3-oxosuccinate Metabolites in cluster 32: C00751 Squalene C06083 Tetrahymanol C06084 Hopanoid C06309 Diplopterol C06310 Diploptene Metabolites in cluster 33: C06322 S-1,5-Cyclohexadiene-1-carboxylatecoenzymeA C06749 6-Hydroxycyclohex-1-enecarbonyl-CoA C09809 Cyclohex-2,5-diene-1-carboxyl-CoA C09810 Cyclohex-1,4-diene-1-carboxyl-CoA C09824 2,6-Dihydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 34: C00843 --Menthone C02485 --Isopiperitenone C09893 Pulegone C11951 +-cis-Isopulegone C11952 +-Isomenthone Metabolites in cluster 35: C08585 Capsorubin C08606 Neoxanthin C08614 Violaxanthin C13431 9'-cis-Neoxanthin C13433 9-cis-Violaxanthin Metabolites in cluster 36: C06205 1,2-Dihydronaphthalene-1,2-diol C11713 beta-Naphthol C11714 alpha-Naphthol C14786 1R,2S-Naphthalene1,2-oxide C14787 1S,2R-Naphthalene1,2-oxide Metabolites in cluster 37: C04717 9Z,11E-13S-13-Hydroperoxyoctadeca-9,11-dienoicacid C07338 9Z,12Z-11S-11-Hydroperoxyoctadeca-9,12-dienoicacid C07354 7S,8S-DiHODE C14827 9S-HPODE C14831 8R-HPODE Metabolites in cluster 38: C00136 Butanoyl-CoA C00630 2-Methylpropanoyl-CoA C02939 3-Methylbutanoyl-CoA C05996 Branchedchainfattyacid C15980 S-2-Methylbutanoyl-CoA Metabolites in cluster 39: C00122 Fumarate C00149 S-Malate C00497 R-Malate C01384 Maleicacid Metabolites in cluster 40: C00094 Sulfite C00320 Thiosulfate C01861 Trithionate C06742 2-2-Hydroxyphenylbenzenesulfinate Metabolites in cluster 41: C00009 Orthophosphate C00013 Pyrophosphate C00536 Triphosphate C02466 Trimetaphosphate Metabolites in cluster 42: C00091 Succinyl-CoA C00683 S-2-Methyl-3-oxopropanoyl-CoA C01213 R-2-Methyl-3-oxopropanoyl-CoA C02557 Methylmalonyl-CoA Metabolites in cluster 43: C00191 D-Glucuronate C00905 D-Fructuronate C02670 D-Glucuronolactone C03387 D-Glucurono-6,2-lactone Metabolites in cluster 44: C00093 sn-Glycerol3-phosphate C00623 Glycerol1-phosphate C02979 Glycerol2-phosphate C03947 Glycerol1,2-cyclicphosphate Metabolites in cluster 45: C00032 Heme C05783 Cytochromea C05784 Catalase C05785 Peroxidase Metabolites in cluster 46: C00376 Retinal C02110 11-cis-Retinal C05918 all-trans-Dehydroretinal C05919 11-cis-Dehydroretinal Metabolites in cluster 47: C03345 2-Methylbut-2-enoyl-CoA C03460 2-Methylprop-2-enoyl-CoA C04405 2S,3S-3-Hydroxy-2-methylbutanoyl-CoA C06000 S-3-Hydroxyisobutyryl-CoA Metabolites in cluster 48: C02226 2-Methylmaleate C02612 R-2-Methylmalate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate Metabolites in cluster 49: C04053 5-Dehydro-4-deoxy-D-glucuronate C04349 4S-4,6-Dihydroxy-2,5-dioxohexanoate C04733 4-4-Deoxy-beta-D-gluc-4-enuronosyl-D-galacturonate C06118 4-4-Deoxy-alpha-D-gluc-4-enuronosyl-D-galacturonate Metabolites in cluster 50: C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine Metabolites in cluster 51: C00333 D-Galacturonate C00558 D-Tagaturonate C02273 Digalacturonate C06430 D-Galacturonolactone Metabolites in cluster 52: C01255 N-6-Aminohexanoyl-6-aminohexanoate C02378 6-Aminohexanoate C04277 1,8-Diazacyclotetradecane-2,9-dione C06593 epsilon-Caprolactam Metabolites in cluster 53: C06595 gamma-Hexachlorocyclohexane C06596 gamma-Pentachlorocyclohexene C06597 1,3,4,6-Tetrachloro-1,4-cyclohexadiene C06598 2,4,5-Trichloro-2,5-cyclohexadiene-1-ol Metabolites in cluster 54: C00189 Ethanolamine C05714 alpha-Aminopropiononitrile C06771 Triethanolamine C06772 Diethanolamine Metabolites in cluster 55: C00691 2,4,6/3,5-Pentahydroxycyclohexanone C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid Metabolites in cluster 56: C06714 3-Hydroxypimeloyl-CoA C06723 6-Carboxyhex-2-enoyl-CoA C09821 6-Ketoxycyclohex-1-ene-1-carboxyl-CoA C09825 6-Oxo-2-hydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 57: C02880 Protochlorophyllide C04536 Magnesiumprotoporphyrinmonomethylester C11829 131-Hydroxy-magnesium-protoporphyrinIX13-monomethylester C11830 131-Oxo-magnesium-protoporphyrinIX13-monomethylester Metabolites in cluster 58: C12415 Nogalonicacidmethylester C12417 Auraviketone C12418 Dihydro-NAME C12419 Auramycinone Metabolites in cluster 59: C00509 Naringenin C06561 Isosalipurpol C06563 Genistein C12631 2-Hydroxy-2,3-dihydrogenistein Metabolites in cluster 60: C13620 TetrabromobisphenolA C13621 TribromobisphenolA C13622 DibromobisphenolA C13623 MonobromobisphenolA Metabolites in cluster 61: C04188 S-Methyl-5-thio-D-ribose1-phosphate C04582 S-Methyl-5-thio-D-ribulose1-phosphate C15650 2,3-Diketo-5-methylthiopentyl-1-phosphate C15651 2-Hydroxy-3-keto-5-methylthiopentenyl-1-phosphate Metabolites in cluster 62: C04525 Fecosterol C15777 Episterol C15780 5-Dehydroepisterol C15781 24-Methylenecholesterol Metabolites in cluster 63: C05418 Cholesterol-5beta,6beta-epoxide C05419 Cholesterol-5alpha,6beta-epoxide C05425 3beta,5alpha,6beta-Cholestanetriol C15992 Cholesterol-5alpha,6alpha-epoxide Metabolites in cluster 64: C06988 beta-1,2,3,4,5,6-Hexachlorocyclohexane C06989 delta-3,4,5,6-Tetrachlorocyclohexene C11352 5,6-Dichloro-1,3-cyclohexadiene C16181 beta-2,3,4,5,6-Pentachlorocyclohexanol Metabolites in cluster 65: C00786 --Vestitone C10503 --Medicarpin C16187 7,2'-Dihydroxy-4'-methoxy-isoflavanol C16225 --Vestitol Metabolites in cluster 66: C00007 Oxygen C00027 H2O2 C00034 Manganese Metabolites in cluster 67: C00121 D-Ribose C00216 D-Arabinose C00309 D-Ribulose Metabolites in cluster 68: C00181 D-Xylose C00310 D-Xylulose C00476 D-Lyxose Metabolites in cluster 69: C00041 L-Alanine C00133 D-Alanine C00993 D-Alanyl-D-alanine Metabolites in cluster 70: C00488 Formamide C01326 Hydrogencyanide C02659 Acetonecyanohydrin Metabolites in cluster 71: C00140 N-Acetyl-D-glucosamine C00645 N-Acetyl-D-mannosamine C01674 Chitobiose Metabolites in cluster 72: C00507 L-Rhamnose C00861 L-Rhamnulose C02431 L-Rhamnofuranose Metabolites in cluster 73: C00479 Propanal C00583 Propane-1,2-diol C02948 4-Hydroxyhexan-3-one Metabolites in cluster 74: C00880 D-Galactonate C01216 2-Dehydro-3-deoxy-D-galactonate C03383 D-Galactono-1,4-lactone Metabolites in cluster 75: C00141 3-Methyl-2-oxobutanoicacid C04039 2,3-Dihydroxy-3-methylbutanoate C04272 R-2,3-Dihydroxy-3-methylbutanoate Metabolites in cluster 76: C02504 2S-2-Isopropylmalate C02631 2-Isopropylmaleate C04411 2R,3S-3-Isopropylmalate Metabolites in cluster 77: C04174 trans-2-Decenoyl-acyl-carrierprotein C04180 cis-3-Decenoyl-acyl-carrierprotein C04619 3R-3-Hydroxydecanoyl-acyl-carrierprotein Metabolites in cluster 78: C02741 Phosphoribosyl-AMP C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide Metabolites in cluster 79: C02944 3-cis-Dodecenoyl-CoA C03221 2-trans-Dodecenoyl-CoA C05262 S-3-Hydroxydodecanoyl-CoA Metabolites in cluster 80: C05417 5,6beta-Epoxy-5beta-cholestane C05423 5,6beta-Epoxy-5alpha-cholestane C05424 5alpha-Cholestan-5,6beta-diol Metabolites in cluster 81: C01694 Ergosterol C04416 5alpha-Ergosta-7,22-diene-3beta,5-diol C05441 VitaminD2 Metabolites in cluster 82: C01866 beta-Lactam C03806 Substitutedbeta-aminoacid C05551 PenicillinG Metabolites in cluster 83: C01251 2-Hydroxybutane-1,2,4-tricarboxylate C04002 But-1-ene-1,2,4-tricarboxylate C05662 Homoisocitrate Metabolites in cluster 84: C00827 Lactoyl-CoA C00894 Propenoyl-CoA C05668 3-Hydroxypropionyl-CoA Metabolites in cluster 85: C01024 Hydroxymethylbilane C01051 UroporphyrinogenIII C05766 UroporphyrinogenI Metabolites in cluster 86: C05793 L-Urobilin C05794 I-Urobilin C05795 D-Urobilin Metabolites in cluster 87: C00116 Glycerol C00969 3-Hydroxypropanal C05999 Lactaldehyde Metabolites in cluster 88: C00847 4-Pyridoxate C00971 4-Pyridoxolactone C06050 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate Metabolites in cluster 89: C01880 6-Hexanolide C06101 Hexan-1-ol-6-oate C06103 6-Hydroxyhexanoicacid Metabolites in cluster 90: C00346 Ethanolaminephosphate C01120 Sphinganine1-phosphate C06124 Sphingosine1-phosphate Metabolites in cluster 91: C04706 cis-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C04729 trans-2-Chloro-4-carboxymethylenebut-2-en-1,4-olide C06329 2-Chloromaleylacetate Metabolites in cluster 92: C06639 2,2-Bis4'-chlorophenylethanol C06640 Bis4'-chlorophenylacetate C06642 unsym-Bis4'-chlorophenylethylene Metabolites in cluster 93: C03918 2,4-Dichloro-cis,cis-muconate C04625 2,4-Dichloro-2,5-dihydro-5-oxofuran-2-acetate C07095 2,5-Dichloro-cis,cis-muconate Metabolites in cluster 94: C07111 Ethylbenzene C07112 1-Phenylethanol C11348 S-1-Phenylethanol Metabolites in cluster 95: C11428 trans-9S,10S-Dihydrodiolphenanthrene C11429 Phenanthrene-9,10-oxide C11430 9-Hydroxyphenanthrene Metabolites in cluster 96: C07271 Limonene-1,2-epoxide C07276 Limonene-1,2-diol C11937 1S,4R-1-Hydroxy-2-oxolimonene Metabolites in cluster 97: C11945 trans-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11946 cis-2-Methyl-5-isopropylhexa-2,5-dienoyl-CoA C11947 3-Hydroxy-2,6-dimethyl-5-methylene-heptanoyl-CoA Metabolites in cluster 98: C12107 AHBA C12108 AminoDHS C12109 AminoDHQ Metabolites in cluster 99: C12319 dTDP-3-amino-2,3,6-trideoxy-C-methyl-D-erythro-hexopyranos-4-ulose C12320 dTDP-L-4-oxovancosamine C12322 dTDP-L-vancosamine Metabolites in cluster 100: C12422 Aklanonicacidmethylester C12423 Aklaviketone C12424 Aklavinone Metabolites in cluster 101: C01907 Daunorubicin C12430 13-Dihydrodaunorubicin C12433 13S-13-Dihydrodaunorubicin Metabolites in cluster 102: C14101 2-Naphthoicacid C14111 5,6,7,8-Tetrahydro-2-naphthoicacid C14113 Decahydro-2-naphthoicacid Metabolites in cluster 103: C14116 Naphthyl-2-methyl-succinyl-CoA C14117 Naphthyl-2-methylene-succinyl-CoA C14118 Naphthyl-2-hydroxymethyl-succinylCoA Metabolites in cluster 104: C12176 ProansamycinX C12246 ProtorifamycinI C14721 34a-Deoxy-rifamycinW Metabolites in cluster 105: C14722 RifamycinW-hemiacetal C14724 Demethyl-desacetyl-rifamycinS C14725 Demethyl-desacetyl-rifamycinSV Metabolites in cluster 106: C06314 LipoxinA4 C06315 LipoxinB4 C14815 5,6-Epoxytetraene Metabolites in cluster 107: C14840 Bromobenzene-2,3-oxide C14841 2-Bromophenol C14842 Bromobenzene-2,3-dihydrodiol Metabolites in cluster 108: C14871 S-Formylmethylglutathione C14874 Glutathioneepisulfoniumion C14875 S-2-Hydroxyethylglutathione Metabolites in cluster 109: C08821 Isofucosterol C15782 delta7-Avenasterol C15783 5-Dehydroavenasterol Metabolites in cluster 110: C09707 Phaseicacid C15514 8'-Hydroxyabscisate C15971 Dihydrophaseicacid Metabolites in cluster 111: C02505 2-Phenylacetamide C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime Metabolites in cluster 112: C14315 Anthracene C16205 Anthracene-9,10-dihydrodiol C16206 9,10-Dihydroxyanthracene Metabolites in cluster 113: C16277 R.g.-KetoI C16279 Thiothece-474 C16280 Okenone Metabolites in cluster 114: C02094 beta-Carotene C15943 Isorenieratene C16340 beta-Isorenieratene Metabolites in cluster 115: C00134 Putrescine C02714 N-Acetylputrescine Metabolites in cluster 116: C00019 S-Adenosyl-L-methionine C00170 5'-Methylthioadenosine Metabolites in cluster 117: C00218 Methylamine C02722 N-Methylhexanamide Metabolites in cluster 118: C00186 S-Lactate C00256 R-Lactate Metabolites in cluster 119: C00259 L-Arabinose C00508 L-Ribulose Metabolites in cluster 120: C00148 L-Proline C00763 D-Proline Metabolites in cluster 121: C00473 Retinol C00899 11-cis-Retinol Metabolites in cluster 122: C00612 N1-Acetylspermidine C01029 N8-Acetylspermidine Metabolites in cluster 123: C00619 3-Oxo-delta4-steroid C01034 3-Oxo-delta5-steroid Metabolites in cluster 124: C00800 L-Gulonate C01040 L-Gulono-1,4-lactone Metabolites in cluster 125: C01097 D-Tagatose6-phosphate C01113 D-Galactose6-phosphate Metabolites in cluster 126: C00779 Scytalone C01173 1,3,8-Naphthalenertriol Metabolites in cluster 127: C00501 CDP-glucose C01219 CDP-4-dehydro-6-deoxy-D-glucose Metabolites in cluster 128: C00011 CO2 C01353 Carbonicacid Metabolites in cluster 129: C00261 Benzaldehyde C01408 Benzoin Metabolites in cluster 130: C00423 trans-Cinnamate C01456 Tropate Metabolites in cluster 131: C00312 L-Xylulose C01508 L-Lyxose Metabolites in cluster 132: C00084 Acetaldehyde C01548 Acetylene Metabolites in cluster 133: C01424 Gallate C01572 Digallate Metabolites in cluster 134: C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01717 4-Hydroxy-2-quinolinecarboxylicacid Metabolites in cluster 135: C01019 6-Deoxy-L-galactose C01721 L-Fuculose Metabolites in cluster 136: C01494 Ferulate C01752 Scopoletin Metabolites in cluster 137: C00810 R-Acetoin C01769 S-Acetoin Metabolites in cluster 138: C00927 IsonocardicinA C01941 NocardicinA Metabolites in cluster 139: C00897 alpha-Maltose C01971 beta-Maltose Metabolites in cluster 140: C00844 R-Prunasin C01982 R-Amygdalin Metabolites in cluster 141: C01983 R-Mandelate C01984 S-Mandelate Metabolites in cluster 142: C01659 Acrylamide C01998 Acrylonitrile Metabolites in cluster 143: C01479 Atropine C02046 L-Hyoscyamine Metabolites in cluster 144: C00601 Phenylacetaldehyde C02083 Styreneoxide Metabolites in cluster 145: C01066 Cyclohexane-1,3-dione C02129 5-Oxohexanoicacid Metabolites in cluster 146: C01943 Obtusifoliol C02141 Cycloeucalenol Metabolites in cluster 147: C02271 Dichloromethane C02661 Bromochloromethane Metabolites in cluster 148: C01198 3-2-Hydroxyphenylpropanoate C02274 Dihydrocoumarin Metabolites in cluster 149: C01951 Piperitenone C02289 Isopiperitenone Metabolites in cluster 150: C00524 Cytochromec C02416 Holocytochromec Metabolites in cluster 151: C02200 UDP-glucosamine C02467 UDP-galactosamine Metabolites in cluster 152: C00123 L-Leucine C02486 3R-beta-Leucine Metabolites in cluster 153: C01590 Kievitone C02549 Kievitonehydrate Metabolites in cluster 154: C01987 2-Aminophenol C02720 N-Hydroxyarylamine Metabolites in cluster 155: C01757 Triacetate C02752 Triacetatelactone Metabolites in cluster 156: C02037 Glycylglycine C02777 2,5-Dioxopiperazine Metabolites in cluster 157: C01839 Orsellinate C02868 Orsellinatedepside Metabolites in cluster 158: C01863 Xanthoaphin C02879 Protoaphinaglucone Metabolites in cluster 159: C03036 +-Bisdechlorogeodin C03040 --Bisdechlorogeodin Metabolites in cluster 160: C01090 16alpha-Hydroxysteroid C03050 16beta-Hydroxysteroid Metabolites in cluster 161: C02411 Glutaconyl-1-CoA C03058 2-Hydroxyglutaryl-CoA Metabolites in cluster 162: C02660 Benzylthiocyanate C03098 Benzylisothiocyanate Metabolites in cluster 163: C00712 9Z-Octadecenoicacid C03195 R-10-Hydroxystearate Metabolites in cluster 164: C01126 2-trans,6-trans-Farnesol C03220 2-cis,6-trans-Farnesol Metabolites in cluster 165: C03178 Tetrahydroxypteridine C03314 Xanthine-8-carboxylate Metabolites in cluster 166: C01157 trans-4-Hydroxy-L-proline C03440 cis-4-Hydroxy-D-proline Metabolites in cluster 167: C03319 dTDP-6-deoxy-L-mannose C03442 dTDP-L-dihydrostreptose Metabolites in cluster 168: C02588 Retinylpalmitate C03455 11-cis-Retinylpalmitate Metabolites in cluster 169: C00445 5,10-Methenyltetrahydrofolate C03479 5-Formyltetrahydrofolate Metabolites in cluster 170: C01593 Limonoate C03514 LimonoateD-ring-lactone Metabolites in cluster 171: C01110 5-Amino-2-oxopentanoicacid C03564 1-Pyrroline-2-carboxylate Metabolites in cluster 172: C01775 Actinomycin C03597 Actinomycinicmonolactone Metabolites in cluster 173: C03598 CDP-3,6-dideoxy-D-glucose C03599 CDP-3,6-dideoxy-D-mannose Metabolites in cluster 174: C01171 alpha-D-Hexose1-phosphate C03735 alpha-D-Hexose6-phosphate Metabolites in cluster 175: C03207 16-Dehydroprogesterone C03748 16alpha-Hydroxyprogesterone Metabolites in cluster 176: C01075 N-Sulfo-D-glucosamine C03789 N,6-O-Disulfo-D-glucosamine Metabolites in cluster 177: C02161 Isophenoxazine C03824 2-Aminomuconatesemialdehyde Metabolites in cluster 178: C01720 L-Fuconate C03827 2-Dehydro-3-deoxy-L-fuconate Metabolites in cluster 179: C01189 5alpha-Cholest-7-en-3beta-ol C03845 5alpha-Cholest-8-en-3beta-ol Metabolites in cluster 180: C01165 L-Glutamate5-semialdehyde C03912 S-1-Pyrroline-5-carboxylate Metabolites in cluster 181: C03871 L-2-Amino-6-oxoheptanedioate C03972 2,3,4,5-Tetrahydrodipicolinate Metabolites in cluster 182: C01595 Linoleate C04056 9-cis,11-trans-Octadecadienoate Metabolites in cluster 183: C00450 2,3,4,5-Tetrahydropyridine-2-carboxylate C04076 L-2-Aminoadipate6-semialdehyde Metabolites in cluster 184: C03239 6-Amino-2-oxohexanoate C04092 delta1-Piperideine-2-carboxylate Metabolites in cluster 185: C03205 11-Deoxycorticosterone C04108 20-Hydroxy-3-oxopregn-4-en-21-al Metabolites in cluster 186: C00318 L-Carnitine C04114 4-Trimethylammoniobut-2-enoate Metabolites in cluster 187: C04073 Heparosan-N-sulfateL-iduronate C04196 Heparosan-N-sulfateD-glucuronate Metabolites in cluster 188: C02027 Deoxylimonate C04251 DeoxylimononicacidD-ring-lactone Metabolites in cluster 189: C03356 3-Phospho-D-erythronate C04309 Phosphoenol-4-deoxy-3-tetrulosonate Metabolites in cluster 190: C01274 5-Formyl-5,6,7,8-tetrahydromethanopterin C04330 5,10-Methenyltetrahydromethanopterin Metabolites in cluster 191: C01711 Inulobiose C04333 Bis-D-fructose2',1:2,1'-dianhydride Metabolites in cluster 192: C01197 3,4-Dihydroxy-trans-cinnamate C04366 3-2-Carboxyethenyl-cis,cis-muconate Metabolites in cluster 193: C02759 alpha-Pinene-oxide C04435 Z-2-Methyl-5-isopropylhexa-2,5-dienal Metabolites in cluster 194: C01089 R-3-Hydroxybutanoate C04546 R-3-R-3-Hydroxybutanoyloxybutanoate Metabolites in cluster 195: C00451 1R,2S-1-Hydroxypropane-1,2,3-tricarboxylate C04617 1S,2S-1-Hydroxypropane-1,2,3-tricarboxylate Metabolites in cluster 196: C04621 E-2-2-Furyl-3-5-nitro-2-furylacrylamide C04622 Z-2-2-Furyl-3-5-nitro-2-furylacrylamide Metabolites in cluster 197: C01267 3-Imidazol-4-yl-2-oxopropylphosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate Metabolites in cluster 198: C01291 3-4-Methylpent-3-en-1-yl-pent-2-enedioyl-CoA C04675 3-Hydroxy-3-4-methylpent-3-en-1-ylglutaryl-CoA Metabolites in cluster 199: C01618 Testolate C04676 Testololactone Metabolites in cluster 200: C04685 13E-15S-15-Hydroxy-9-oxoprosta-10,13-dienoate C04686 13E-15S-15-Hydroxy-9-oxoprosta-11,13-dienoate Metabolites in cluster 201: C04843 5Z,9E,14Z-8xi,11xi,12S-8,11,12-Trihydroxyicosa-5,9,14-trienoate C04849 5Z,9E,14Z-8xi,11R,12S-11,12-Epoxy-8-hydroxyicosa-5,9,14-trienoicacid Metabolites in cluster 202: C04864 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine4-sulfate C04865 4-Deoxy-beta-D-gluc-4-enuronosyl-1,3-N-acetyl-D-galactosamine6-sulfate Metabolites in cluster 203: C05110 4alpha-Methylcholesta-8-en-3beta-ol C05111 Methostenol Metabolites in cluster 204: C04027 delta1-Pyrroline2-carboxylate C05147 trans-L-3-Hydroxyproline Metabolites in cluster 205: C05190 6-Hydroxyprotopine C05191 Dihydrosanguinarine Metabolites in cluster 206: C05229 Phaseollidinhydrate C05230 Phaseollidin Metabolites in cluster 207: C05268 S-Hydroxyhexanoyl-CoA C05271 trans-Hex-2-enoyl-CoA Metabolites in cluster 208: C05258 S-3-Hydroxyhexadecanoyl-CoA C05272 trans-Hexadec-2-enoyl-CoA Metabolites in cluster 209: C05260 S-3-Hydroxytetradecanoyl-CoA C05273 trans-Tetradec-2-enoyl-CoA Metabolites in cluster 210: C05264 S-Hydroxydecanoyl-CoA C05275 trans-Dec-2-enoyl-CoA Metabolites in cluster 211: C05266 S-Hydroxyoctanoyl-CoA C05276 trans-Oct-2-enoyl-CoA Metabolites in cluster 212: C05277 S-3-Hydroxycapryloyl-CoA C05278 R-3-Hydroxycapryloyl-CoA Metabolites in cluster 213: C05279 trans,cis-Lauro-2,6-dienoyl-CoA C05280 cis,cis-3,6-Dodecadienoyl-CoA Metabolites in cluster 214: C05294 19-Hydroxytestosterone C05295 19-Oxotestosterone Metabolites in cluster 215: C03198 S-4-Hydroxymandelate C05343 R-4-Hydroxymandelate Metabolites in cluster 216: C01179 3-4-Hydroxyphenylpyruvate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate Metabolites in cluster 217: C03752 2-Amino-2-deoxy-D-gluconate C05383 Aminosugars Metabolites in cluster 218: C05413 Phytoene C05414 Phytofluene Metabolites in cluster 219: C05437 Zymosterol C05439 5alpha-Cholesta-7,24-dien-3beta-ol Metabolites in cluster 220: C01753 Sitosterol C05442 Stigmasterol Metabolites in cluster 221: C01164 Cholesta-5,7-dien-3beta-ol C05443 VitaminD3 Metabolites in cluster 222: C05447 3alpha,7alpha-Dihydroxy-5beta-cholest-24-enoyl-CoA C05448 3alpha,7alpha,24-Trihydroxy-5beta-cholestanoyl-CoA Metabolites in cluster 223: C05450 3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestanoyl-CoA C05460 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholest-24-enoyl-CoA Metabolites in cluster 224: C00487 Carnitine C05543 3-Dehydroxycarnitine Metabolites in cluster 225: C04826 5-3-Carboxy-3-oxopropenyl-4,6-dihydroxypyridine-2-carboxylate C05641 5-3'-Carboxy-3'-oxopropenyl-4,6-dihydroxypicolinate Metabolites in cluster 226: C02470 Xanthurenicacid C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate Metabolites in cluster 227: C05652 4-2-Amino-5-hydroxyphenyl-2,4-dioxobutanoate C05663 6-Hydroxykynurenate Metabolites in cluster 228: C05677 Lipophosphonoglycan C05678 1-Hydroxy-2-aminoethylphosphonate Metabolites in cluster 229: C00227 Acetylphosphate C05682 Phosphonoacetate Metabolites in cluster 230: C05688 Selenocysteine C05704 Selenocystine Metabolites in cluster 231: C05698 Selenohomocysteine C05707 Selenohomocystine Metabolites in cluster 232: C01708 Hemoglobin C05782 Myoglobin Metabolites in cluster 233: C05789 L-Urobilinogen C05790 I-Urobilinogen Metabolites in cluster 234: C02730 2-Succinylbenzoate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate Metabolites in cluster 235: C05838 cis-2-Hydroxycinnamate C05851 Coumarin Metabolites in cluster 236: C04281 L-1-Pyrroline-3-hydroxy-5-carboxylate C05938 L-4-Hydroxyglutamatesemialdehyde Metabolites in cluster 237: C03069 3-Methylcrotonyl-CoA C05998 3-Hydroxyisovaleryl-CoA Metabolites in cluster 238: C00671 S-3-Methyl-2-oxopentanoicacid C06007 R-2,3-Dihydroxy-3-methylpentanoate Metabolites in cluster 239: C04773 3-Hydroxy-4-hydroxymethyl-2-methylpyridine-5-carboxylate C06052 5-Pyridoxolactone Metabolites in cluster 240: C00169 Carbamoylphosphate C06059 Cyclicamidines Metabolites in cluster 241: C04718 1,6,6-Trimethyl-2,7-dioxabicyclo3.2.2nonan-3-one C06066 4,5-Dihydro-5,5-dimethyl-4-3-oxobutylfuran-23H-onehexanoate Metabolites in cluster 242: C06067 Dimethylallyltryptophan C06068 Elymoclavine Metabolites in cluster 243: C03470 3-alphaS-Strictosidine C06073 Indolealkaloid Metabolites in cluster 244: C06102 Adipatesemialdehyde C06105 Cyclohexan-1,2-dione Metabolites in cluster 245: C00164 Acetoacetate C06144 3-Butynoate Metabolites in cluster 246: C06171 7,8-Didehydro-4,5-epoxy-3-methoxy-17-methoxy-5_-morphinan-6-one C06172 Neopinone Metabolites in cluster 247: C00783 Tropinone C06179 Hygrine Metabolites in cluster 248: C02718 N-Formiminoglycine C06195 Imidazolone Metabolites in cluster 249: C06390 16-alpha-Hydroxypregnenolone C06392 16,17-Didehydropregnenolone Metabolites in cluster 250: C06395 Protein-L-serine C06396 Protein-D-serine Metabolites in cluster 251: C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose Metabolites in cluster 252: C06399 Hydrogenobyrinate C06408 Precorrin8X Metabolites in cluster 253: C00629 2-Dehydro-D-gluconate C06440 2-Dehydro-D-glucono-1,5-lactone Metabolites in cluster 254: C06231 Ectoine C06442 N-gamma-Acetyldiaminobutyrate Metabolites in cluster 255: C06486 6R-6-L-erythro-1,2-Dihydroxypropyl-5,6,7,8-tetrahydro-4a-hydroxypterin C06487 6R-6-L-erythro-1,2-Dihydroxypropyl-7,8-dihydro-6H-pterin Metabolites in cluster 256: C01380 Ethyleneglycol C06548 Ethyleneoxide Metabolites in cluster 257: C05557 IsopenicillinN C06564 PenicillinN Metabolites in cluster 258: C03206 12-Dehydrotetracycline C06624 Oxytetracycline Metabolites in cluster 259: C06623 dTDP-4-oxo-3-methyl-2,6-dideoxy-beta-L-glucose C06631 dTDP-beta-L-mycarose Metabolites in cluster 260: C06644 1,1-Dichloro-2-dihydroxy-4'-chlorophenyl-2-4'-chlorophenylethylene C06645 6-Oxo-2-hydroxy-7-4'-chlorophenyl-3,8,8-trichloroocta-2E,4E,7E-trienoate Metabolites in cluster 261: C02370 4-Chlorobenzoate C06648 4-Chlorobenzaldehyde Metabolites in cluster 262: C06661 Clavulanate-9-aldehyde C06662 Clavulanicacid Metabolites in cluster 263: C06675 3-Sulfomuconate C06676 4-Sulfolactone Metabolites in cluster 264: C07090 Protoanemonin C07091 cis-Acetylacrylate Metabolites in cluster 265: C07299 Cutin C07300 Cutinmonomer Metabolites in cluster 266: C07304 Deacetylisoipecoside C07307 Deacetylipecoside Metabolites in cluster 267: C07722 3,4-Dihydroxy-3,4-dihydro-9-fluorenone C07723 4-Hydroxy-9-fluorenone Metabolites in cluster 268: C00281 Sedoheptulose7-phosphate C07836 D-glycero-D-manno-Heptose7-phosphate Metabolites in cluster 269: C03103 Cyclobutadipyrimidine C08249 Pyrimidine5'-deoxynucleotide Metabolites in cluster 270: C08576 Aureusidin C08577 Bracteatin Metabolites in cluster 271: C08579 Antheraxanthin C08584 Capsanthin Metabolites in cluster 272: C08980 SoyasapogenolB C08983 SoyasaponinI Metabolites in cluster 273: C09024 Ajmalicine C09241 Serpentine Metabolites in cluster 274: C00766 Flavanone C09321 2'-Hydroxychalcone Metabolites in cluster 275: C08578 Butein C09614 Butin Metabolites in cluster 276: C01378 Fustin C09736 Fisetinidol-4beta-ol Metabolites in cluster 277: C09811 Cyclohex-1-ene-1-carboxyl-CoA C09812 2-Hydroxycyclohexane-1-carboxyl-CoA Metabolites in cluster 278: C01063 6-Carboxyhexanoyl-CoA C09813 2-Ketocyclohexane-1-carboxyl-CoA Metabolites in cluster 279: C09814 Benzonitrile C09815 Benzamide Metabolites in cluster 280: C09818 E-Phenylitaconyl-CoA C09819 Hydroxymethylphenylsuccinyl-CoA Metabolites in cluster 281: C01562 Calycosin C10522 Pseudobaptigenin Metabolites in cluster 282: C06178 1-Methylpyrrolinium C10974 4-Methylaminobutanal Metabolites in cluster 283: C09844 1,8-Cineole C11393 --alpha-Terpineol Metabolites in cluster 284: C01767 --Carvone C11395 4R,6R-cis-Carveol Metabolites in cluster 285: C11404 3R-6-Hydroxy-3-isopropenyl-heptanoate C11405 3R-3-Isopropenyl-6-oxoheptanoate Metabolites in cluster 286: C11383 +-S-Carvone C11408 4S,6S-cis-Carveol Metabolites in cluster 287: C11417 3S-6-Hydroxy-3-isopropenyl-heptanoate C11419 3S-3-Isopropenyl-6-oxoheptanoate Metabolites in cluster 288: C11431 Phenanthrene-1,2-oxide C11432 1-Phenanthrol Metabolites in cluster 289: C11519 N-Cyclohexylformamide C11520 Cyclohexylisocyanide Metabolites in cluster 290: C01204 myo-Inositolhexakisphosphate C11526 5-PP-InsP5 Metabolites in cluster 291: C05773 Cobyrinate C11545 Cobalt-precorrin8 Metabolites in cluster 292: C02151 Geissoschizine C11632 Polyneuridinealdehyde Metabolites in cluster 293: C11633 16-Epivellosimine C11634 Vellosimine Metabolites in cluster 294: C00695 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholanate C11637 3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate Metabolites in cluster 295: C07201 Vinblastine C11641 3',4'-Anhydrovinblastine Metabolites in cluster 296: C01512 Loganate C11672 10-Deoxygeniposidicacid Metabolites in cluster 297: C04578 16-Methoxy-2,3-dihydro-3-hydroxytabersonine C11675 16-Methoxytabersonine Metabolites in cluster 298: C03309 Strictosidineaglycone C11678 Dialdehyde Metabolites in cluster 299: C09337 Ankorine C11816 Protoemetine Metabolites in cluster 300: C05306 Chlorophylla C11850 Divinylchlorophylla Metabolites in cluster 301: C06096 GibberellinA29 C11855 GibberellinA29-catabolite Metabolites in cluster 302: C11859 GibberellinA37openlactone C11862 GibberellinA36 Metabolites in cluster 303: C11854 GibberellinA51-catabolite C11865 GibberellinA51 Metabolites in cluster 304: C11863 GibberellinA9 C11866 2,3-Dehydro-gibberellinA9 Metabolites in cluster 305: C11864 GibberellinA4 C11867 GibberellinA7 Metabolites in cluster 306: C11868 GibberellinA34 C11869 GibberellinA34-catabolite Metabolites in cluster 307: C03579 2beta-Hydroxygibberellin1 C11870 GibberellinA8-catabolite Metabolites in cluster 308: C02035 GibberellinA20 C11871 GibberellinA5 Metabolites in cluster 309: C11884 Neoabietinol C11885 Neoabietal Metabolites in cluster 310: C11883 Levopimarinol C11886 Levopimarinal Metabolites in cluster 311: C11882 Abietinol C11887 Abietal Metabolites in cluster 312: C11922 dTDP-4-oxo-2,6-dideoxy-D-glucose C11923 dTDP-D-olivose Metabolites in cluster 313: C11927 dTDP-4-oxo-2,6-dideoxy-L-mannose C11928 dTDP-4-oxo-2,6-dideoxy-D-allose Metabolites in cluster 314: C11929 Perillyl-CoA C11934 2-Hydroxy-4-isopropenylcyclohexane-1-carboxyl-CoA Metabolites in cluster 315: C11935 4-Isopropenyl-2-oxy-cyclohexanecarboxyl-CoA C11936 3-Isopropenylpimelyl-CoA Metabolites in cluster 316: C06428 5Z,8Z,11Z,14Z,17Z-Icosapentaenoicacid C12083 5Z,7E,9E,14Z,17Z-Eicosapentaenoicacid Metabolites in cluster 317: C12213 Kanosamine6-phosphate C12214 Aminofructose6-phosphate Metabolites in cluster 318: C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate Metabolites in cluster 319: C12366 TetracenomycinF2 C12367 TetracenomycinF1 Metabolites in cluster 320: C12396 Tetrangomycin C12397 Tetrangulol Metabolites in cluster 321: C12410 UrdamycinoneF C12412 Aquayamycin Metabolites in cluster 322: C12431 13-Dihydrocarminomycin C12432 Carminomycin Metabolites in cluster 323: C12434 S-DNPA C12435 5-Deoxodihydrokalafungin Metabolites in cluster 324: C12436 Dihydrokalafungin C12437 Medermycin Metabolites in cluster 325: C10858 Ecgonine C12449 Pseudoecgonine Metabolites in cluster 326: C06181 Piperideine C12455 5-Aminopentanal Metabolites in cluster 327: C12834 2,5-Dichloro-carboxymethylenebut-2-en-4-olide C12835 2,5-Dichloro-4-oxohex-2-enedioate Metabolites in cluster 328: C06082 Abscisate C13454 Xanthoxicacid Metabolites in cluster 329: C13455 Abscisicaldehyde C13456 Abscisicalcohol Metabolites in cluster 330: C13626 5-HydroxybisphenolA C13628 4,5-Bisphenol-o-quinone Metabolites in cluster 331: C13629 1,2-Bis4-hydroxyphenyl-2-propanol C13632 4,4'-Dihydroxy-alpha-methylstilbene Metabolites in cluster 332: C14092 cis-1,2-Dihydroxy-1,2-dihydro-8-carboxynaphthalene C14093 1,2-Dihydroxy-8-carboxynaphthalene Metabolites in cluster 333: C14144 5-Carboxy-2-pentenoyl-CoA C14145 3S-3-Hydroxyadipyl-CoA Metabolites in cluster 334: C06006 S-2-Aceto-2-hydroxybutanoate C14463 R-3-Hydroxy-3-methyl-2-oxopentanoate Metabolites in cluster 335: C12044 Rifamycin C14540 RifamycinS Metabolites in cluster 336: C14602 3-Hydroxyaminophenol C14604 Aminohydroquinone Metabolites in cluster 337: C12247 RifamycinW C14723 RifamycinZ Metabolites in cluster 338: C14768 5,6-EET C14772 5,6-DHET Metabolites in cluster 339: C14769 8,9-EET C14773 8,9-DHET Metabolites in cluster 340: C14770 11,12-EET C14774 11,12-DHET Metabolites in cluster 341: C14771 14,15-EET C14775 14,15-DHET Metabolites in cluster 342: C03012 Naphthalene-1,2-diol C14783 1,2-Naphthoquinone Metabolites in cluster 343: C02617 1,4-Naphthoquinone C14785 1,4-Dihydroxynaphthalene Metabolites in cluster 344: C14788 1-Nitrosonaphthalene C14789 N-Hydroxy-1-aminonaphthalene Metabolites in cluster 345: C14800 1-Nitronaphthalene-5,6-oxide C14801 1-Nitro-5,6-dihydroxy-dihydronaphthalene Metabolites in cluster 346: C14825 910-EpOME C14828 9,10-DHOME Metabolites in cluster 347: C14826 1213-EpOME C14829 12,13-DHOME Metabolites in cluster 348: C14556 9-Hydroxybenzoapyrene C14849 Benzoapyrene-9,10-oxide Metabolites in cluster 349: C14850 Benzoapyrene-7,8-oxide C14852 Benzoapyrene-7,8-diol Metabolites in cluster 350: C14858 2,2-Dichloroacetaldehyde C14860 2,2-Dichloro-1,1-ethanediol Metabolites in cluster 351: C06899 Chloralhydrate C14866 Chloral Metabolites in cluster 352: C11148 TCEepoxide C14867 Dichloroacetylchloride Metabolites in cluster 353: C05631 Eriodictyol C15525 Eriodictyolchalcone Metabolites in cluster 354: C03160 2-Succinylbenzoyl-CoA C15547 1,4-Dihydroxy-2-naphthoyl-CoA Metabolites in cluster 355: C15568 7alpha,12alpha-Dihydroxy-3-oxochol-4-enoate C15569 12alpha-Hydroxy-3-oxochola-4,6-dienoate Metabolites in cluster 356: C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole Metabolites in cluster 357: C00555 4-Aminobutanal C15668 1-Pyrroline Metabolites in cluster 358: C11522 24-Methylenelophenol C15776 4alpha-Methylfecosterol Metabolites in cluster 359: C01789 Campesterol C15784 Campest-4-en-3beta-ol Metabolites in cluster 360: C15786 5alpha-Campestan-3-one C15787 Campestanol Metabolites in cluster 361: C15788 6alpha-Hydroxycampestanol C15789 6-Oxocampestanol Metabolites in cluster 362: C15795 22alpha-Hydroxy-campesterol C15796 22alpha-Hydroxy-campest-4-en-3-one Metabolites in cluster 363: C15797 22alpha-Hydroxy-5alpha-campestan-3-one C15798 6-Deoxocathasterone Metabolites in cluster 364: C02646 4-Coumarylalcohol C15804 p-Hydroxyphenyllignin Metabolites in cluster 365: C00590 Coniferylalcohol C15805 Guaiacyllignin Metabolites in cluster 366: C02325 Sinapylalcohol C15806 Syringyllignin Metabolites in cluster 367: C12205 5-Hydroxyconiferylalcohol C15807 5-Hydroxy-guaiacyllignin Metabolites in cluster 368: C00037 Glycine C15809 Iminoglycine Metabolites in cluster 369: C15814 C15814 C15815 C15815 Metabolites in cluster 370: C15877 Anhydrorhodovibrin C15878 Rhodovibrin Metabolites in cluster 371: C14151 delta-Tocopherol C15882 2-Methyl-6-phytylquinol Metabolites in cluster 372: C02483 gamma-Tocopherol C15883 2,3-Dimethyl-5-phytylquinol Metabolites in cluster 373: C15884 2-Ketospirilloxanthin C15885 2,2'-Diketospirilloxanthin Metabolites in cluster 374: C15886 3,4-Dihydroanhydrorhodovibrin C15887 3',4'-Dihydrorhodovibrin Metabolites in cluster 375: C15900 Spheroidene C15902 Hydroxyspheroidene Metabolites in cluster 376: C15903 Spheroidenone C15905 Hydroxyspheroidenone Metabolites in cluster 377: C01115 L-Galactono-1,4-lactone C15930 L-Galactonate Metabolites in cluster 378: C15928 4-Ketomyxol C15932 4-Hydroxymyxol Metabolites in cluster 379: C16014 cis-Stilbeneoxide C16015 +-1R,2R-1,2-Diphenylethane-1,2-diol Metabolites in cluster 380: C16144 Dehydrosqualene C16145 4,4'-Diaponeurosporene Metabolites in cluster 381: C14899 3-Dehydro-L-gulonate6-phosphate C16186 L-Ascorbate6-phosphate Metabolites in cluster 382: C16188 7-Hydroxy-2',4',5'-trimethoxyisoflavone C16189 9-Demethylmunduserone Metabolites in cluster 383: C00858 Formononetin C16190 2,7-Dihydroxy-4'-methoxyisoflavanone Metabolites in cluster 384: C16217 3-Hydroxyoctadecanoyl-CoA C16218 2E-Octadecenoyl-CoA Metabolites in cluster 385: C14314 4',6,7-Trihydroxyisoflavone C16233 2,6,7,4'-Tetrahydroxyisoflavanone Metabolites in cluster 386: C00632 3-Hydroxyanthranilate C16235 o-Hydroxylaminobenzoate Metabolites in cluster 387: C04178 3,5-Dibromo-4-hydroxybenzonitrile C16246 3,5-Dibromo-4-hydroxybenzamide Metabolites in cluster 388: C06719 Dihydrophloroglucinol C16272 3-Hydroxy-5-oxohexanoate Metabolites in cluster 389: C05434 beta-Zeacarotene C16291 7,8-Dihydro-beta-carotene Metabolites in cluster 390: C16309 Traumatin C16311 12-Oxo-9Z-dodecenoicacid Metabolites in cluster 391: C16328 trans-2-Enoyl-OPC8-CoA C16329 3-Hydroxy-OPC8-CoA Metabolites in cluster 392: C16332 trans-2-Enoyl-OPC6-CoA C16333 3-Hydroxy-OPC6-CoA Metabolites in cluster 393: C16336 trans-2-Enoyl-OPC4-CoA C16337 3-Hydroxy-OPC4-CoA Metabolites in cluster 394: C16361 1,3,7-Trimethyluricacid C16362 3,6,8-Trimethylallantoin Metabolites in cluster 395: C16374 2E,6Z,9Z,12Z,15Z,18Z,21Z-Tetracosahepta-2,6,9,12,15,18,21-enoyl-CoA C16375 6Z,9Z,12Z,15Z,18Z,21Z-3-Hydroxytetracosahexa-6,9,12,15,18,21-enoyl-CoA Metabolites in cluster 396: C16387 2E,6Z,9Z,12Z,15Z,18Z-Tetracosahexa-2,6,9,12,15,18-enoyl-CoA C16388 6Z,9Z,12Z,15Z,18Z-3-Hydroxytetracosapenta-6,9,12,15,18-enoyl-CoA Metabolites in cluster 397: C09827 Pinocembrin C16404 Pinocembrinchalcone Metabolites in cluster 398: C09756 Homoeriodictyol C16405 Homoeriodictyolchalcone Metabolites in cluster 399: C16409 Aureusidin6-O-glucoside C16410 Bracteatin6-O-glucoside Metabolites in cluster 400: C16402 2,4-Dihydroxylamino-6-nitrotoluene C16414 2-Amino-5-hydroxyl-4-hydroxylamino-6-nitrotoluene Metabolites in cluster 401: C09751 Garbanzol C16415 5-Deoxyleucopelargonidin Metabolites in cluster 402: C09789 Naringin C16423 Naringinchalcone datasetS2/strict/0000755000175000017500000000000010747436025013612 5ustar oliveroliverdatasetS2/strict/reaction_list.txt0000644000175000017500000007214710747436025017225 0ustar oliveroliverR00004 R00005 R00006 R00008 R00009 R00010 R00011 R00012 R00013 R00014 R00015 R00016 R00018 R00022 R00023 R00024 R00025 R00026 R00027 R00028 R00031 R00032 R00033 R00035 R00036 R00038 R00039 R00040 R00042 R00043 R00044 R00045 R00047 R00048 R00049 R00053 R00054 R00055 R00058 R00059 R00062 R00063 R00064 R00066 R00068 R00069 R00070 R00072 R00073 R00074 R00078 R00080 R00083 R00084 R00085 R00086 R00087 R00088 R00089 R00090 R00091 R00093 R00094 R00095 R00099 R00104 R00105 R00112 R00113 R00114 R00115 R00118 R00120 R00122 R00123 R00124 R00125 R00126 R00127 R00128 R00130 R00131 R00132 R00136 R00138 R00139 R00140 R00143 R00149 R00150 R00155 R00156 R00157 R00158 R00159 R00160 R00161 R00173 R00174 R00178 R00181 R00182 R00183 R00184 R00185 R00186 R00187 R00188 R00189 R00190 R00191 R00192 R00193 R00194 R00195 R00199 R00200 R00203 R00206 R00207 R00208 R00211 R00212 R00213 R00217 R00218 R00219 R00220 R00221 R00223 R00224 R00226 R00227 R00228 R00229 R00230 R00233 R00235 R00236 R00237 R00238 R00239 R00240 R00241 R00243 R00245 R00248 R00250 R00251 R00253 R00254 R00256 R00257 R00258 R00259 R00260 R00261 R00262 R00264 R00267 R00269 R00270 R00271 R00272 R00273 R00274 R00275 R00276 R00277 R00278 R00279 R00287 R00289 R00291 R00293 R00299 R00300 R00302 R00303 R00304 R00306 R00307 R00310 R00315 R00316 R00317 R00318 R00319 R00320 R00321 R00322 R00324 R00325 R00327 R00328 R00330 R00332 R00335 R00336 R00337 R00338 R00339 R00340 R00341 R00342 R00343 R00345 R00346 R00347 R00348 R00350 R00351 R00352 R00353 R00354 R00355 R00357 R00359 R00360 R00362 R00363 R00365 R00366 R00368 R00369 R00370 R00371 R00372 R00373 R00396 R00397 R00398 R00399 R00400 R00401 R00402 R00405 R00406 R00407 R00408 R00409 R00410 R00411 R00414 R00415 R00416 R00418 R00420 R00421 R00424 R00425 R00426 R00428 R00429 R00430 R00431 R00432 R00434 R00445 R00446 R00447 R00448 R00449 R00451 R00452 R00453 R00454 R00457 R00458 R00460 R00461 R00462 R00463 R00465 R00466 R00468 R00469 R00470 R00471 R00472 R00473 R00474 R00475 R00477 R00478 R00479 R00480 R00481 R00482 R00483 R00484 R00485 R00486 R00487 R00488 R00489 R00490 R00491 R00494 R00497 R00499 R00501 R00502 R00503 R00504 R00505 R00507 R00508 R00509 R00510 R00511 R00512 R00513 R00514 R00515 R00516 R00517 R00518 R00519 R00521 R00522 R00524 R00525 R00526 R00527 R00529 R00530 R00531 R00532 R00533 R00534 R00535 R00536 R00537 R00548 R00549 R00550 R00551 R00552 R00554 R00556 R00559 R00562 R00563 R00565 R00566 R00567 R00568 R00569 R00570 R00571 R00572 R00573 R00574 R00576 R00578 R00579 R00581 R00582 R00584 R00585 R00586 R00588 R00589 R00590 R00602 R00604 R00605 R00606 R00608 R00610 R00612 R00614 R00615 R00616 R00617 R00618 R00619 R00621 R00642 R00643 R00644 R00645 R00646 R00647 R00648 R00649 R00651 R00652 R00653 R00654 R00655 R00656 R00658 R00659 R00660 R00661 R00662 R00664 R00665 R00666 R00667 R00669 R00670 R00671 R00672 R00673 R00674 R00675 R00676 R00677 R00678 R00679 R00681 R00682 R00684 R00685 R00686 R00687 R00688 R00689 R00690 R00691 R00692 R00693 R00694 R00695 R00697 R00699 R00700 R00703 R00704 R00705 R00706 R00707 R00708 R00709 R00710 R00711 R00713 R00714 R00715 R00716 R00717 R00719 R00720 R00722 R00723 R00724 R00725 R00726 R00727 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R04520 R04522 R04523 R04525 R04526 R04527 R04529 R04531 R04532 R04538 R04540 R04541 R04547 R04549 R04552 R04556 R04557 R04558 R04559 R04560 R04565 R04570 R04572 R04573 R04576 R04577 R04579 R04580 R04587 R04591 R04592 R04593 R04594 R04597 R04602 R04605 R04606 R04608 R04609 R04617 R04618 R04619 R04620 R04621 R04623 R04638 R04639 R04640 R04641 R04657 R04658 R04666 R04671 R04672 R04673 R04674 R04675 R04678 R04680 R04681 R04682 R04683 R04686 R04687 R04688 R04690 R04691 R04694 R04696 R04697 R04699 R04702 R04708 R04709 R04716 R04723 R04728 R04731 R04732 R04734 R04736 R04738 R04740 R04742 R04744 R04746 R04747 R04749 R04751 R04753 R04754 R04756 R04757 R04758 R04770 R04772 R04776 R04777 R04779 R04780 R04781 R04783 R04784 R04785 R04786 R04787 R04789 R04792 R04793 R04804 R04806 R04807 R04809 R04811 R04813 R04817 R04818 R04819 R04823 R04824 R04825 R04826 R04828 R04829 R04830 R04831 R04832 R04833 R04834 R04835 R04836 R04837 R04838 R04839 R04840 R04842 R04843 R04844 R04845 R04846 R04847 R04849 R04850 R04851 R04853 R04854 R04855 R04857 R04862 R04868 R04870 R04872 R04874 R04875 R04882 R04883 R04884 R04888 R04889 R04890 R04891 R04892 R04893 R04894 R04895 R04900 R04901 R04902 R04903 R04907 R04908 R04909 R04911 R04914 R04915 R04916 R04917 R04918 R04929 R04930 R04936 R04941 R04942 R04945 R04946 R04972 R04975 R04979 R04982 R04986 R04998 R04999 R05027 R05028 R05030 R05032 R05033 R05038 R05039 R05043 R05046 R05048 R05049 R05050 R05052 R05053 R05055 R05056 R05057 R05058 R05062 R05064 R05066 R05068 R05069 R05070 R05071 R05074 R05076 R05078 R05083 R05085 R05086 R05087 R05092 R05097 R05099 R05100 R05103 R05104 R05120 R05121 R05124 R05125 R05128 R05130 R05133 R05134 R05135 R05137 R05138 R05141 R05142 R05147 R05148 R05150 R05153 R05154 R05155 R05156 R05157 R05158 R05160 R05165 R05166 R05168 R05169 R05170 R05171 R05172 R05174 R05176 R05177 R05198 R05200 R05202 R05207 R05208 R05217 R05221 R05222 R05224 R05225 R05226 R05228 R05229 R05230 R05231 R05233 R05234 R05236 R05237 R05238 R05239 R05240 R05244 R05245 R05246 R05248 R05251 R05256 R05257 R05259 R05261 R05262 R05263 R05264 R05266 R05267 R05268 R05269 R05271 R05272 R05274 R05275 R05276 R05277 R05278 R05279 R05280 R05283 R05284 R05285 R05287 R05288 R05289 R05290 R05291 R05294 R05295 R05296 R05297 R05298 R05299 R05300 R05301 R05305 R05307 R05308 R05310 R05311 R05312 R05313 R05315 R05317 R05319 R05320 R05321 R05322 R05326 R05328 R05330 R05331 R05332 R05334 R05336 R05337 R05338 R05339 R05341 R05347 R05348 R05349 R05350 R05351 R05353 R05354 R05356 R05357 R05358 R05359 R05360 R05361 R05362 R05363 R05364 R05365 R05367 R05368 R05369 R05370 R05371 R05372 R05373 R05374 R05375 R05376 R05377 R05378 R05379 R05380 R05381 R05382 R05383 R05384 R05385 R05386 R05387 R05388 R05389 R05390 R05391 R05392 R05393 R05394 R05395 R05396 R05397 R05399 R05400 R05401 R05402 R05403 R05404 R05405 R05406 R05407 R05408 R05409 R05410 R05411 R05412 R05413 R05414 R05415 R05417 R05418 R05420 R05421 R05423 R05424 R05425 R05427 R05428 R05429 R05434 R05435 R05436 R05439 R05440 R05441 R05442 R05443 R05444 R05445 R05446 R05447 R05448 R05449 R05450 R05451 R05452 R05455 R05456 R05457 R05465 R05466 R05467 R05468 R05469 R05475 R05477 R05478 R05483 R05484 R05485 R05486 R05487 R05493 R05495 R05498 R05499 R05500 R05501 R05502 R05503 R05504 R05506 R05507 R05508 R05509 R05510 R05511 R05513 R05515 R05516 R05517 R05519 R05527 R05530 R05531 R05533 R05534 R05536 R05538 R05540 R05543 R05544 R05546 R05548 R05549 R05551 R05552 R05553 R05554 R05555 R05558 R05559 R05560 R05561 R05562 R05563 R05564 R05565 R05566 R05567 R05568 R05569 R05571 R05572 R05573 R05574 R05575 R05576 R05581 R05582 R05585 R05586 R05587 R05588 R05590 R05591 R05592 R05593 R05594 R05595 R05596 R05597 R05598 R05599 R05600 R05601 R05602 R05603 R05604 R05605 R05606 R05607 R05608 R05609 R05610 R05612 R05613 R05615 R05616 R05618 R05620 R05621 R05622 R05623 R05626 R05627 R05628 R05629 R05630 R05632 R05633 R05634 R05636 R05637 R05639 R05640 R05641 R05642 R05643 R05644 R05645 R05646 R05647 R05648 R05649 R05650 R05651 R05652 R05653 R05654 R05655 R05656 R05658 R05659 R05660 R05661 R05662 R05663 R05664 R05665 R05668 R05672 R05677 R05678 R05679 R05680 R05681 R05683 R05684 R05685 R05686 R05687 R05688 R05689 R05690 R05691 R05692 R05693 R05694 R05696 R05698 R05699 R05700 R05701 R05702 R05703 R05705 R05706 R05707 R05713 R05714 R05715 R05716 R05717 R05718 R05719 R05720 R05722 R05723 R05724 R05725 R05727 R05728 R05729 R05730 R05731 R05732 R05733 R05735 R05736 R05737 R05738 R05746 R05749 R05750 R05758 R05761 R05762 R05765 R05766 R05767 R05768 R05769 R05771 R05772 R05773 R05774 R05775 R05778 R05779 R05781 R05783 R05784 R05789 R05790 R05791 R05799 R05800 R05801 R05804 R05805 R05812 R05814 R05815 R05823 R05824 R05825 R05826 R05827 R05828 R05830 R05831 R05832 R05833 R05835 R05836 R05838 R05839 R05841 R05842 R05843 R05844 R05845 R05847 R05848 R05850 R05855 R05856 R05857 R05858 R05861 R05862 R05863 R05864 R05865 R05866 R05870 R05874 R05876 R05877 R05878 R05879 R05880 R05882 R05884 R05885 R06047 R06048 R06117 R06119 R06120 R06126 R06146 R06154 R06166 R06171 R06180 R06223 R06254 R06255 R06256 R06257 R06265 R06266 R06267 R06269 R06270 R06271 R06272 R06284 R06286 R06291 R06292 R06294 R06295 R06296 R06298 R06299 R06300 R06301 R06302 R06303 R06304 R06305 R06307 R06308 R06309 R06310 R06311 R06312 R06322 R06323 R06335 R06336 R06337 R06338 R06366 R06369 R06371 R06380 R06381 R06398 R06406 R06407 R06408 R06411 R06412 R06413 R06414 R06415 R06418 R06422 R06423 R06424 R06426 R06428 R06429 R06430 R06431 R06432 R06433 R06434 R06435 R06436 R06437 R06439 R06440 R06447 R06450 R06451 R06452 R06455 R06457 R06460 R06461 R06464 R06466 R06469 R06471 R06472 R06473 R06474 R06475 R06484 R06485 R06486 R06487 R06488 R06489 R06490 R06491 R06492 R06493 R06494 R06495 R06496 R06497 R06498 R06499 R06500 R06501 R06502 R06506 R06510 R06511 R06512 R06513 R06514 R06520 R06521 R06523 R06525 R06529 R06530 R06532 R06533 R06534 R06535 R06536 R06537 R06538 R06539 R06540 R06544 R06545 R06546 R06551 R06556 R06557 R06558 R06559 R06560 R06561 R06562 R06563 R06569 R06570 R06571 R06572 R06573 R06582 R06583 R06589 R06590 R06591 R06592 R06593 R06594 R06595 R06601 R06602 R06603 R06606 R06607 R06610 R06611 R06613 R06615 R06622 R06624 R06626 R06628 R06629 R06631 R06633 R06634 R06649 R06659 R06660 R06662 R06664 R06665 R06666 R06667 R06668 R06675 R06676 R06680 R06681 R06684 R06686 R06715 R06716 R06717 R06718 R06719 R06720 R06728 R06729 R06730 R06734 R06740 R06757 R06758 R06769 R06770 R06772 R06773 R06777 R06778 R06782 R06783 R06784 R06785 R06786 R06787 R06788 R06789 R06792 R06793 R06795 R06796 R06797 R06799 R06800 R06801 R06802 R06803 R06804 R06805 R06806 R06808 R06809 R06810 R06811 R06812 R06813 R06814 R06817 R06818 R06819 R06820 R06821 R06826 R06827 R06828 R06829 R06830 R06831 R06832 R06833 R06834 R06835 R06836 R06838 R06839 R06840 R06842 R06843 R06844 R06845 R06846 R06847 R06848 R06851 R06856 R06857 R06860 R06866 R06869 R06870 R06871 R06883 R06884 R06885 R06886 R06887 R06888 R06890 R06891 R06892 R06893 R06894 R06896 R06897 R06903 R06904 R06905 R06906 R06907 R06908 R06909 R06910 R06911 R06912 R06913 R06914 R06915 R06916 R06917 R06918 R06919 R06921 R06922 R06923 R06924 R06925 R06926 R06927 R06928 R06930 R06931 R06932 R06933 R06934 R06935 R06936 R06937 R06939 R06940 R06941 R06942 R06943 R06944 R06945 R06946 R06947 R06948 R06949 R06950 R06951 R06952 R06953 R06954 R06957 R06960 R06962 R06963 R06965 R06966 R06967 R06968 R06969 R06970 R06971 R06972 R06973 R06974 R06975 R06976 R06977 R06978 R06979 R06980 R06982 R06983 R06985 R06987 R06988 R06989 R06990 R06994 R07000 R07001 R07002 R07003 R07004 R07009 R07010 R07011 R07012 R07013 R07014 R07015 R07016 R07020 R07021 R07022 R07023 R07024 R07025 R07026 R07027 R07031 R07032 R07034 R07035 R07036 R07037 R07038 R07039 R07040 R07041 R07042 R07043 R07044 R07045 R07046 R07047 R07048 R07049 R07050 R07051 R07052 R07053 R07054 R07055 R07056 R07057 R07058 R07059 R07060 R07061 R07062 R07066 R07067 R07068 R07069 R07070 R07071 R07072 R07073 R07074 R07075 R07076 R07079 R07080 R07081 R07082 R07083 R07084 R07085 R07086 R07087 R07088 R07089 R07090 R07091 R07092 R07093 R07094 R07095 R07098 R07099 R07100 R07101 R07102 R07104 R07105 R07106 R07108 R07109 R07110 R07111 R07112 R07116 R07121 R07122 R07124 R07127 R07133 R07134 R07135 R07136 R07137 R07138 R07139 R07140 R07141 R07142 R07143 R07144 R07145 R07146 R07147 R07149 R07150 R07152 R07156 R07164 R07165 R07168 R07170 R07171 R07172 R07173 R07175 R07178 R07179 R07181 R07183 R07184 R07185 R07186 R07187 R07188 R07189 R07190 R07191 R07194 R07195 R07196 R07197 R07198 R07199 R07200 R07201 R07202 R07203 R07204 R07205 R07206 R07207 R07208 R07209 R07211 R07212 R07213 R07215 R07216 R07217 R07219 R07220 R07221 R07222 R07224 R07225 R07245 R07246 R07247 R07248 R07250 R07251 R07252 R07253 R07254 R07257 R07260 R07262 R07263 R07264 R07265 R07267 R07269 R07270 R07271 R07272 R07273 R07274 R07276 R07277 R07279 R07280 R07281 R07289 R07290 R07294 R07295 R07296 R07298 R07300 R07301 R07302 R07303 R07304 R07305 R07306 R07307 R07311 R07313 R07315 R07316 R07317 R07318 R07319 R07320 R07321 R07322 R07323 R07324 R07329 R07337 R07339 R07340 R07342 R07345 R07346 R07353 R07354 R07355 R07360 R07362 R07363 R07364 R07365 R07366 R07367 R07368 R07369 R07370 R07371 R07372 R07373 R07378 R07392 R07393 R07394 R07395 R07396 R07399 R07400 R07401 R07402 R07403 R07405 R07406 R07407 R07408 R07410 R07413 R07414 R07415 R07416 R07417 R07418 R07419 R07420 R07421 R07422 R07423 R07426 R07427 R07428 R07432 R07433 R07434 R07437 R07440 R07441 R07442 R07455 R07457 R07458 R07475 R07476 R07477 R07483 R07484 R07488 R07493 R07494 R07497 R07500 R07502 R07503 R07510 R07511 R07512 R07513 R07514 R07515 R07516 R07518 R07519 R07522 R07523 R07525 R07526 R07528 R07532 R07534 R07536 R07537 R07538 R07539 R07540 R07543 R07574 R07576 R07582 R07583 R07584 R07597 R07598 R07599 R07601 R07603 R07605 R07613 R07627 R07629 R07630 R07631 R07632 R07636 R07638 R07645 R07647 R07648 R07649 R07650 R07651 R07657 R07658 R07659 R07660 R07661 R07662 R07663 R07664 R07665 R07666 R07667 R07668 R07669 R07670 R07672 R07673 R07674 R07675 R07676 R07677 R07678 R07680 R07684 R07686 R07687 R07688 R07689 R07691 R07692 R07700 R07701 R07702 R07703 R07704 R07705 R07706 R07707 R07708 R07709 R07710 R07711 R07713 R07714 R07715 R07718 R07719 R07720 R07721 R07723 R07725 R07727 R07728 R07729 R07730 R07731 R07734 R07736 R07740 R07741 R07746 R07747 R07748 R07751 R07752 R07753 R07754 R07757 R07758 R07759 R07760 R07761 R07770 R07772 R07773 R07776 R07777 R07778 R07779 R07780 R07782 R07793 R07794 R07795 R07796 R07797 R07798 R07799 R07800 R07801 R07802 R07804 R07827 R07828 R07829 R07830 R07831 R07832 R07833 R07836 R07837 R07839 R07840 R07848 R07849 R07854 R07855 R07856 R07863 R07864 R07865 R07866 R07867 R07868 R07869 R07870 R07871 R07872 R07873 R07874 R07875 R07876 R07877 R07878 R07879 R07880 R07881 R07882 R07883 R07884 R07885 R07886 R07887 R07888 R07889 R07890 R07891 R07892 R07893 R07894 R07895 R07896 R07897 R07898 R07899 R07902 R07903 R07910 R07911 R07912 R07913 R07914 R07917 R07923 R07926 R07927 R07928 R07929 R07930 R07931 R07932 R07934 R07935 R07936 R07937 R07938 R07939 R07942 R07944 R07950 R07951 R07952 R07953 R07954 R07955 R07956 R07957 R07958 R07959 R07960 R07961 R07962 R07963 R07964 R07965 R07966 R07967 R07968 R07969 R07970 R07971 R07972 R07973 R07974 R07975 R07976 R07977 R07978 R07979 R07980 R07981 R07983 R07984 R07985 R07986 R07987 R07988 R07989 R07990 R07991 R07992 R07993 R07995 R07996 R07997 R07998 R07999 R08002 R08003 R08005 R08008 R08009 R08010 R08013 R08014 R08015 R08016 R08017 R08018 R08019 R08021 R08022 R08024 R08032 R08036 R08042 R08043 R08044 R08045 R08046 R08047 R08048 R08050 datasetS2/strict/consensus_scopes.txt0000644000175000017500000023345710747436025017765 0ustar oliveroliverConsensus scope of cluster 1 C00001 H2O C00007 Oxygen C00011 CO2 C00014 NH3 C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00048 Glyoxylate C00049 L-Aspartate C00058 Formate C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00086 Urea C00090 Catechol C00099 beta-Alanine C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00122 Fumarate C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00146 Phenol C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00179 Agmatine C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00217 D-Glutamate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00232 Succinatesemialdehyde C00237 CO C00251 Chorismate C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00288 HCO3- C00292 Aniline C00295 Orotate C00311 Isocitrate C00327 L-Citrulline C00328 L-Kynurenine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00380 Cytosine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00463 Indole C00472 p-Benzoquinone C00483 Tyramine C00488 Formamide C00490 Itaconate C00497 R-Malate C00499 Allantoate C00502 D-Xylonate C00515 D-Ornithine C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00632 3-Hydroxyanthranilate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00792 D-Arginine C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00940 2-Oxoglutaramate C00944 3-Dehydroquinate C00954 Indole-3-acetate C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01179 3-4-Hydroxyphenylpyruvate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01326 Hydrogencyanide C01353 Carbonicacid C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01596 Maleamate C01602 Ornithine C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01769 S-Acetoin C01987 2-Aminophenol C01990 3-Oxalomalate C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02362 2-Oxosuccinamate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02659 Acetonecyanohydrin C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03139 N-Amidino-L-aspartate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03277 Imidazol-5-yl-pyruvate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03722 Pyridine-2,3-dicarboxylate C03738 gamma-L-Glutamyl-D-alanine C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C03981 2-Hydroxyethylenedicarboxylate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05332 Phenethylamine C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05380 Nicotinurate C05405 L-Arabinono-1,5-lactone C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06160 S-Norcoclaurine C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06224 3,4-Dihydroxystyrene C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06393 2,3-Diaminopropanoate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15523 2,6-Dihydroxynicotinate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 2 C00001 H2O C00007 Oxygen C00011 CO2 C00022 Pyruvate C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00084 Acetaldehyde C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00530 p-Benzenediol C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00804 Propynoate C00810 R-Acetoin C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02341 trans-Aconitate C02351 1,2-Benzoquinone C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02923 2,3-Dihydroxytoluene C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate Consensus scope of cluster 3 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00058 Formate C00067 Formaldehyde C00080 H+ C00085 D-Fructose6-phosphate C00089 Sucrose C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00132 Methanol C00137 myo-Inositol C00159 D-Mannose C00184 Glycerone C00185 Cellobiose C00191 D-Glucuronate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00227 Acetylphosphate C00231 D-Xylulose5-phosphate C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00447 D-Sedoheptulose1,7-bisphosphate C00514 D-Mannonate C00536 Triphosphate C00546 Methylglyoxal C00577 D-Glyceraldehyde C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00629 2-Dehydro-D-gluconate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C00905 D-Fructuronate C00969 3-Hydroxypropanal C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01742 Palatinose C02013 Cellotetraose C02048 Laminaribiose C02336 beta-D-Fructose C02466 Trimetaphosphate C02591 Sucrose6-phosphate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03546 myo-Inositol4-phosphate C03661 1F-beta-D-Fructosylsucrose C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05682 Phosphonoacetate C05999 Lactaldehyde C06019 D-arabino-3-Hexulose6-phosphate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone C07836 D-glycero-D-manno-Heptose7-phosphate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate Consensus scope of cluster 4 C00001 H2O C00002 ATP C00007 Oxygen C00008 ADP C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00020 AMP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00035 GDP C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00044 GTP C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00054 Adenosine3',5'-bisphosphate C00055 CMP C00058 Formate C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00081 ITP C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00096 GDP-mannose C00099 beta-Alanine C00103 D-Glucose1-phosphate C00104 IDP C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00130 IMP C00131 dATP C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00144 GMP C00146 Phenol C00147 Adenine C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00167 UDP-glucuronate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00179 Agmatine C00181 D-Xylose C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00190 UDP-D-xylose C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00206 dADP C00207 Acetone C00208 Maltose C00209 Oxalate C00212 Adenosine C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00242 Guanine C00243 Lactose C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00259 L-Arabinose C00262 Hypoxanthine C00263 L-Homoserine C00266 Glycolaldehyde C00267 alpha-D-Glucose C00270 N-Acetylneuraminate C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00286 dGTP C00288 HCO3- C00292 Aniline C00294 Inosine C00295 Orotate C00299 Uridine C00300 Creatine C00301 ADP-ribose C00309 D-Ribulose C00310 D-Xylulose C00311 Isocitrate C00312 L-Xylulose C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00330 Deoxyguanosine C00331 Indolepyruvate C00333 D-Galacturonate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00360 dAMP C00361 dGDP C00362 dGMP C00365 dUMP C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00394 GDP-glucose C00398 Tryptamine C00402 D-Aspartate C00415 Dihydrofolate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00460 dUTP C00463 Indole C00472 p-Benzoquinone C00475 Cytidine C00476 D-Lyxose C00483 Tyramine C00488 Formamide C00490 Itaconate C00492 Raffinose C00493 Shikimate C00497 R-Malate C00498 ADP-glucose C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00508 L-Ribulose C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00526 Deoxyuridine C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00558 D-Tagaturonate C00559 Deoxyadenosine C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00575 3',5'-CyclicAMP C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00617 UDP-D-galacturonate C00618 3-Dehydro-L-gulonate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00652 D-Arabinono-1,4-lactone C00655 Xanthosine5'-phosphate C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00691 2,4,6/3,5-Pentahydroxycyclohexanone C00700 XTP C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00795 D-Tagatose C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00860 L-Histidinol C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00921 Dihydropteroate C00935 UDP-L-arabinose C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00942 3',5'-CyclicGMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00988 2-Phosphoglycolate C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01100 L-Histidinolphosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01133 N-Acetyl-D-glucosaminate C01146 2-Hydroxy-3-oxopropanoate C01151 D-Ribose1,5-bisphosphate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01201 Nomega-ADP-D-ribosyl-L-arginine C01204 myo-Inositolhexakisphosphate C01214 1-Amino-1-deoxy-scyllo-inositol C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01218 6-Phospho-2-dehydro-D-gluconate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01222 GDP-4-dehydro-6-deoxy-D-mannose C01225 sn-glycero-3-Phospho-1-inositol C01228 Guanosine3',5'-bisdiphosphate C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01267 3-Imidazol-4-yl-2-oxopropylphosphate C01268 5-Amino-6-5'-phosphoribosylaminouracil C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01283 1-Amino-1-deoxy-scyllo-inositol4-phosphate C01284 1D-myo-Inositol1,3,4,5,6-pentakisphosphate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01300 2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01304 2,5-Diamino-6-5'-phosphoribosylamino-4-pyrimidineone C01326 Hydrogencyanide C01346 dUDP C01353 Carbonicacid C01367 3'-AMP C01368 3'-UMP C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01508 L-Lyxose C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01594 Linamarin C01596 Maleamate C01602 Ornithine C01613 Stachyose C01623 UDP-apiose C01674 Chitobiose C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01742 Palatinose C01762 Xanthosine C01769 S-Acetoin C01801 Deoxyribose C01825 L-Galactose C01879 5-Oxoproline C01888 Aminoacetone C01987 2-Aminophenol C01990 3-Oxalomalate C01993 5'-Oxoinosine C02013 Cellotetraose C02048 Laminaribiose C02067 Pseudouridine C02076 Sedoheptulose C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02238 5-Oxo-L-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02273 Digalacturonate C02280 GDP-L-galactose C02294 Methylguanidine C02305 Phosphocreatine C02330 UDP-L-iduronate C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02353 2',3'-CyclicAMP C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02362 2-Oxosuccinamate C02385 AminoacidArg- C02405 Formylphosphate C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02655 6-Acetyl-D-glucose C02659 Acetonecyanohydrin C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02718 N-Formiminoglycine C02720 N-Hydroxyarylamine C02726 N4-Phosphoagmatine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02739 Phosphoribosyl-ATP C02741 Phosphoribosyl-AMP C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02993 L-Tyrosyl-L-arginine C02995 Maltose6'-phosphate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03082 4-Phospho-L-aspartate C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03153 N5-Methyl-L-glutamine C03166 Phosphoguanidinoacetate C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03204 10-Formyldihydrofolate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03277 Imidazol-5-yl-pyruvate C03287 L-Glutamyl5-phosphate C03291 L-Xylulose5-phosphate C03293 N-Adenylylanthranilate C03373 Aminoimidazoleribotide C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03483 Adenosinetetraphosphate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03614 Inosine5'-tetraphosphate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03684 6-Pyruvoyltetrahydropterin C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03709 N-Adenylyl-L-phenylalanine C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03734 alpha-D-Glutamylphosphate C03736 alpha-D-Ribose5-phosphate C03737 alpha-D-Xylose1-phosphate C03738 gamma-L-Glutamyl-D-alanine C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03794 N6-1,2-Dicarboxyethyl-AMP C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03838 5'-Phosphoribosylglycinamide C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03872 L-Serine-phosphoethanolamine C03906 beta-L-Arabinose1-phosphate C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03932 5-Dehydro-2-deoxy-D-gluconate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03971 1F-alpha-D-Galactosylraffinose C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C04006 1D-myo-Inositol3-phosphate C04030 2,3-Dihydroxybenzoyladenylate C04037 1-Phospho-alpha-D-galacturonate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04051 5-Amino-4-imidazolecarboxyamide C04052 5-Carboxy-2-oxohept-3-enedioate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04089 UDP-4-dehydro-6-deoxy-D-glucose C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04133 N-Acetyl-L-glutamate5-phosphate C04138 Nalpha-gamma-L-Glutamylhistamine C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04204 N-2,3-Dihydroxybenzoyl-L-serine C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04287 3,5/4-Trihydroxycyclohexa-1,2-dione C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04307 P1,P2-Bis5'-adenosyltriphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04376 5'-Phosphoribosyl-N-formylglycinamide C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04477 1D-myo-Inositol1,3,4,6-tetrakisphosphate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04494 Guanosine3'-diphosphate5'-triphosphate C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04520 1D-myo-Inositol3,4,5,6-tetrakisphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04563 D-myo-Inositol1,2,4,5,6-pentakisphosphate C04579 Inositol1,2,3,4,5-pentakisphosphate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04640 2-Formamido-N1-5'-phosphoribosylacetamidine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04666 D-erythro-1-Imidazol-4-ylglycerol3-phosphate C04677 1-5'-Phosphoribosyl-5-amino-4-imidazolecarboxamide C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04751 1-5-Phospho-D-ribosyl-5-amino-4-imidazolecarboxylate C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04807 2-Amino-7,8-dihydro-4-hydroxy-6-diphosphooxymethylpteridine C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04874 2-Amino-4-hydroxy-6-D-erythro-1,2,3-trihydroxypropyl-7,8-dihydropteridine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C04895 2-Amino-4-hydroxy-6-erythro-1,2,3-trihydroxypropyldihydropteridinetriphosphate C04896 5-5-Phospho-D-ribosylaminoformimino-1-5-phosphoribosyl-imidazole-4-carboxamide C04916 N-5'-Phospho-D-1'-ribulosylformimino-5-amino-1-5''-phospho-D-ribosyl-4-imidazolecarboxamide C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05239 5-Aminoimidazole C05332 Phenethylamine C05340 beta-Alanyl-L-arginine C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05385 D-Glucuronate1-phosphate C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05512 Deoxyinosine C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05765 L-Glutamyl1-phosphate C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05822 3'-CMP C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05922 Formamidopyrimidinenucleosidetriphosphate C05923 2,5-Diaminopyrimidinenucleosidetriphosphate C05925 Dihydroneopterinphosphate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05945 L-Argininephosphate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05993 Acetyladenylate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06148 2,5-Diamino-6-5'-triphosphoryl-3',4'-trihydroxy-2'-oxopentyl-amino-4-oxopyrimidine C06156 alpha-D-Glucosamine1-phosphate C06160 S-Norcoclaurine C06186 Arbutin C06187 Arbutin6-phosphate C06189 Cyclic2,3-bisphospho-D-glycerate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06195 Imidazolone C06197 P1,P3-Bis5'-adenosyltriphosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06222 Sedoheptulose1-phosphate C06224 3,4-Dihydroxystyrene C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06397 ADP-D-glycero-D-manno-heptose C06398 ADP-L-glycero-D-manno-heptose C06430 D-Galacturonolactone C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06655 L-N2-2-Carboxyethylarginine C06656 Deoxyguanidinoproclavaminicacid C06657 Guanidinoproclavaminicacid C06658 Proclavaminicacid C06659 Dihydroclavaminicacid C06660 Clavaminicacid C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06891 D-2,3-Diketo4-deoxy-epi-inositol C06892 2-Deoxy-5-keto-D-gluconicacid C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C07838 D-glycero-D-manno-Heptose1-phosphate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C10517 2-beta-D-Glucosyl-sn-glycerol3-phosphate C11174 1-Diphosinositolpentakisphosphate C11355 4-Amino-4-deoxychorismate C11437 1-Deoxy-D-xylulose5-phosphate C11472 D-glycero-D-manno-Heptose1,7-bisphosphate C11500 5'-Dehydroadenosine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11516 2-alpha-D-Mannosyl-3-phosphoglycerate C11526 5-PP-InsP5 C11527 4-Hydroxymandelate C11544 2alpha-D-Mannosyl-D-glycerate C11546 2-beta-D-Glucosyl-sn-glycerol C11555 1D-myo-Inositol1,4,5,6-tetrakisphosphate C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C14830 GDP-4-keto-6-L-deoxygalactose C14899 3-Dehydro-L-gulonate6-phosphate C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15563 2-Amino-5-formylamino-6-5-phosphoribosylaminopyrimidin-43H-one C15667 5-carboxyamino-1-5-phospho-D-ribosylimidazole C15668 1-Pyrroline C15699 gamma-L-Glutamylputrescine C15700 gamma-Glutamyl-gamma-aminobutyraldehyde C15767 gamma-Glutamyl-gamma-aminobutyraye C15925 GDP-L-gulose C15926 L-Galactose1-phosphate C15990 1L-myo-Inositol1,2,3,4,6-pentakisphosphate C15991 myo-Inositolpentakisphosphate C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16186 L-Ascorbate6-phosphate C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 5 C00001 H2O C00007 Oxygen C00027 H2O2 C00031 D-Glucose C00080 H+ C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00704 O2.- C00794 D-Sorbitol C00817 D-Altronate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01742 Palatinose C02013 Cellotetraose C02336 beta-D-Fructose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03661 1F-beta-D-Fructosylsucrose C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Consensus scope of cluster 6 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00014 NH3 C00015 UDP C00022 Pyruvate C00025 L-Glutamate C00026 2-Oxoglutarate C00027 H2O2 C00029 UDP-glucose C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00037 Glycine C00041 L-Alanine C00042 Succinate C00043 UDP-N-acetyl-D-glucosamine C00048 Glyoxylate C00049 L-Aspartate C00052 UDP-D-galactose C00055 CMP C00058 Formate C00062 L-Arginine C00063 CTP C00064 L-Glutamine C00065 L-Serine C00067 Formaldehyde C00074 Phosphoenolpyruvate C00075 UTP C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00080 H+ C00082 L-Tyrosine C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00086 Urea C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00099 beta-Alanine C00103 D-Glucose1-phosphate C00105 UMP C00106 Uracil C00108 Anthranilate C00109 2-Oxobutanoate C00111 Glyceronephosphate C00112 CDP C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00119 5-Phospho-alpha-D-ribose1-diphosphate C00121 D-Ribose C00122 Fumarate C00124 D-Galactose C00128 CMP-N-acetylneuraminate C00132 Methanol C00133 D-Alanine C00134 Putrescine C00135 L-Histidine C00137 myo-Inositol C00140 N-Acetyl-D-glucosamine C00146 Phenol C00148 L-Proline C00149 S-Malate C00152 L-Asparagine C00153 Nicotinamide C00156 4-Hydroxybenzoate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00166 Phenylpyruvate C00168 Hydroxypyruvate C00169 Carbamoylphosphate C00179 Agmatine C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00188 L-Threonine C00189 Ethanolamine C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00203 UDP-N-acetyl-D-galactosamine C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00213 Sarcosine C00216 D-Arabinose C00217 D-Glutamate C00218 Methylamine C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00232 Succinatesemialdehyde C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00239 dCMP C00243 Lactose C00251 Chorismate C00252 Isomaltose C00253 Nicotinate C00254 Prephenate C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00270 N-Acetylneuraminate C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00288 HCO3- C00292 Aniline C00295 Orotate C00299 Uridine C00300 Creatine C00309 D-Ribulose C00311 Isocitrate C00327 L-Citrulline C00328 L-Kynurenine C00329 D-Glucosamine C00331 Indolepyruvate C00334 4-Aminobutanoate C00337 S-Dihydroorotate C00345 6-Phospho-D-gluconate C00346 Ethanolaminephosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00355 3,4-Dihydroxy-L-phenylalanine C00357 N-Acetyl-D-glucosamine6-phosphate C00365 dUMP C00380 Cytosine C00386 Carnosine C00388 1H-Imidazole-4-ethanamine C00392 Mannitol C00398 Tryptamine C00402 D-Aspartate C00417 cis-Aconitate C00423 trans-Cinnamate C00429 5,6-Dihydrouracil C00433 2,5-Dioxopentanoate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00446 alpha-D-Galactose1-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00458 dCTP C00460 dUTP C00463 Indole C00472 p-Benzoquinone C00475 Cytidine C00483 Tyramine C00488 Formamide C00490 Itaconate C00492 Raffinose C00497 R-Malate C00499 Allantoate C00501 CDP-glucose C00502 D-Xylonate C00513 CDP-glycerol C00514 D-Mannonate C00515 D-Ornithine C00526 Deoxyuridine C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00548 Phenylacetate C00552 meso-Tartaricacid C00555 4-Aminobutanal C00568 4-Aminobenzoate C00570 CDP-ethanolamine C00577 D-Glyceraldehyde C00581 Guanidinoacetate C00596 2-Hydroxy-2,4-pentadienoate C00601 Phenylacetaldehyde C00603 --Ureidoglycolate C00611 N-Acetyllactosamine C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00624 N-Acetyl-L-glutamate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00632 3-Hydroxyanthranilate C00636 D-Mannose1-phosphate C00637 Indole-3-acetaldehyde C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00645 N-Acetyl-D-mannosamine C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00705 dCDP C00711 Malate C00716 Serine C00740 D-Serine C00763 D-Proline C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00794 D-Sorbitol C00804 Propynoate C00805 Salicylate C00810 R-Acetoin C00811 4-Coumarate C00817 D-Altronate C00818 D-Glucarate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00880 D-Galactonate C00881 Deoxycytidine C00884 Homocarnosine C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00940 2-Oxoglutaramate C00941 3',5'-CyclicCMP C00944 3-Dehydroquinate C00954 Indole-3-acetate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00977 L-Tryptophanamide C00988 2-Phosphoglycolate C00993 D-Alanyl-D-alanine C01005 O-Phospho-L-serine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01035 4-Guanidinobutanoate C01036 4-Maleylacetoacetate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01046 N-Methyl-L-glutamate C01059 2,5-Dihydroxypyridine C01061 4-Fumarylacetoacetate C01073 N-Acetyl-beta-alanine C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01097 D-Tagatose6-phosphate C01101 L-Ribulose5-phosphate C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01108 1,2,3-Trihydroxybenzene C01110 5-Amino-2-oxopentanoicacid C01112 D-Arabinose5-phosphate C01113 D-Galactose6-phosphate C01114 L-Arabinono-1,4-lactone C01118 O-Succinyl-L-homoserine C01127 4-Hydroxy-2-oxoglutarate C01133 N-Acetyl-D-glucosaminate C01146 2-Hydroxy-3-oxopropanoate C01157 trans-4-Hydroxy-L-proline C01158 1-O-Galloyl-beta-D-glucose C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01165 L-Glutamate5-semialdehyde C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01197 3,4-Dihydroxy-trans-cinnamate C01215 2-Acetamidomethylenesuccinate C01216 2-Dehydro-3-deoxy-D-galactonate C01219 CDP-4-dehydro-6-deoxy-D-glucose C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01233 sn-glycero-3-Phosphoethanolamine C01234 1-Aminocyclopropane-1-carboxylate C01235 1-alpha-D-Galactosyl-myo-inositol C01236 D-Glucono-1,5-lactone6-phosphate C01239 N-Acetyl-beta-D-glucosaminylamine C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01250 N-Acetyl-L-glutamate5-semialdehyde C01252 4-2-Aminophenyl-2,4-dioxobutanoate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01326 Hydrogencyanide C01346 dUDP C01353 Carbonicacid C01368 3'-UMP C01384 Maleicacid C01405 Aspirin C01417 Cyanate C01424 Gallate C01548 Acetylene C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01572 Digallate C01582 Galactose C01594 Linamarin C01596 Maleamate C01602 Ornithine C01613 Stachyose C01674 Chitobiose C01717 4-Hydroxy-2-quinolinecarboxylicacid C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01888 Aminoacetone C01987 2-Aminophenol C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02083 Styreneoxide C02091 Ureidoglycine C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02161 Isophenoxazine C02167 Maleylpyruvate C02218 2-Aminoacrylate C02220 2-Aminomuconate C02225 2-Methylcitrate C02237 5-Oxo-D-proline C02265 D-Phenylalanine C02266 D-Xylonolactone C02294 Methylguanidine C02305 Phosphocreatine C02336 beta-D-Fructose C02341 trans-Aconitate C02348 R--Allantoin C02350 S+-Allantoin C02351 1,2-Benzoquinone C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02362 2-Oxosuccinamate C02466 Trimetaphosphate C02470 Xanthurenicacid C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02505 2-Phenylacetamide C02512 3-Cyano-L-alanine C02514 3-Fumarylpyruvate C02532 D-O-Phosphoserine C02565 N-Methylhydantoin C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02642 3-Ureidopropionate C02647 4-Guanidinobutanal C02655 6-Acetyl-D-glucose C02659 Acetonecyanohydrin C02670 D-Glucuronolactone C02674 Deoxyribonolactone C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02714 N-Acetylputrescine C02720 N-Hydroxyarylamine C02730 2-Succinylbenzoate C02734 Phenolicphosphate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02775 2,3-Dihydroxyindole C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02916 S-Norlaudanosoline C02923 2,3-Dihydroxytoluene C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02946 4-Acetamidobutanoate C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03063 2-Oxohept-3-enedioate C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03079 4-Hydroxy-L-glutamate C03090 5-Phosphoribosylamine C03097 Arylbeta-D-glucoside C03139 N-Amidino-L-aspartate C03142 N-D-Glucosylarylamine C03167 Phosphonoacetaldehyde C03175 Shikimate3-phosphate C03217 2-Hydroxy-3-oxoadipate C03223 3,4-Dihydroxyphthalate C03227 3-Hydroxy-L-kynurenine C03230 3-Indoleglycolaldehyde C03232 3-Phosphonooxypyruvate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03269 D-galacto-Hexodialdose C03277 Imidazol-5-yl-pyruvate C03291 L-Xylulose5-phosphate C03383 D-Galactono-1,4-lactone C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03506 Indoleglycerolphosphate C03508 L-2-Amino-3-oxobutanoicacid C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03557 2-Aminoethylphosphonate C03564 1-Pyrroline-2-carboxylate C03569 2,2',3-Trihydroxybiphenyl C03574 2-Formylaminobenzaldehyde C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03716 Oxaloacetate4-methylester C03722 Pyridine-2,3-dicarboxylate C03733 UDP-alpha-D-galacto-1,4-furanose C03736 alpha-D-Ribose5-phosphate C03738 gamma-L-Glutamyl-D-alanine C03752 2-Amino-2-deoxy-D-gluconate C03758 4-2-Aminoethyl-1,2-benzenediol C03765 4-Hydroxyphenylacetaldehyde C03771 5-Guanidino-2-oxopentanoate C03785 D-Tagatose1,6-bisphosphate C03824 2-Aminomuconatesemialdehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03848 6F-alpha-D-Galactosylsucrose C03861 Dibenzo1,4dioxin-2,3-dione C03872 L-Serine-phosphoethanolamine C03912 S-1-Pyrroline-5-carboxylate C03921 2-Dehydro-3-deoxy-D-glucarate C03943 2R,4S-2,4-Diaminopentanoate C03947 Glycerol1,2-cyclicphosphate C03961 erythro-3-Hydroxy-L-aspartate C03971 1F-alpha-D-Galactosylraffinose C03981 2-Hydroxyethylenedicarboxylate C03993 4-beta-D-Glucosyloxybenzoate C04006 1D-myo-Inositol3-phosphate C04043 3,4-Dihydroxyphenylacetaldehyde C04044 3-2,3-Dihydroxyphenylpropanoate C04045 3-3,4-Dihydroxyphenylpyruvate C04052 5-Carboxy-2-oxohept-3-enedioate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04089 UDP-4-dehydro-6-deoxy-D-glucose C04101 1-O,6-O-Digalloyl-beta-D-glucose C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04121 CMP-3-deoxy-D-manno-octulosonate C04124 Indole-3-acetyl-beta-1-D-glucose C04164 trans-Cinnamoylbeta-D-glucoside C04171 2,3-Dihydro-2,3-dihydroxybenzoate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04227 1-4-Hydroxyphenyl-2-aminoethanol C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04302 N-5-Phospho-D-ribosylanthranilate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04366 3-2-Carboxyethenyl-cis,cis-muconate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04409 2-Amino-3-carboxymuconatesemialdehyde C04415 4-O-beta-D-Glucosyl-4-hydroxycinnamate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04501 N-Acetyl-alpha-D-glucosamine1-phosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04548 1-4-Hydroxyphenyl-2-methylaminoethanol C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04631 UDP-N-acetyl-3-1-carboxyvinyl-D-glucosamine C04641 2-alpha-D-Galactosyl-sn-glycerol3-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C04703 alpha-D-Galactosyl-1,1'-sn-glycerol3-phosphate C04739 UDP-N-acetyl-6-D-galactose-1-phospho-D-glucosamine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04847 alpha-D-Galactosyl-1,3-beta-D-galactosyl-1,4-N-acetyl-D-glucosamine C04886 alpha-N-Acetylneuraminyl-2,6-beta-D-galactosyl-1,4-N-acetyl-beta-D-glucosamine C05130 Imidazole-4-acetaldehyde C05133 4-Imidazolone-5-acetate C05332 Phenethylamine C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05380 Nicotinurate C05382 D-Sedoheptulose7-phosphate C05396 Lactose6-phosphate C05399 Melibiitol C05400 Epimelibiose C05401 3-beta-D-Galactosyl-sn-glycerol C05402 Melibiose C05404 D-Galalpha1->6D-Galalpha1->6D-Glucose C05405 L-Arabinono-1,5-lactone C05519 L-Allothreonine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05627 4-Hydroxystyrene C05636 3-Hydroxykynurenamine C05637 4,8-Dihydroxyquinoline C05645 4-2-Amino-3-hydroxyphenyl-2,4-dioxobutanoate C05653 Formylanthranilate C05672 2-Amino-3-phosphonopropanoate C05673 CMP-2-aminoethylphosphonate C05682 Phosphonoacetate C05711 gamma-Glutamyl-beta-cyanoalanine C05817 2-Succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate C05822 3'-CMP C05829 N-Carbamyl-L-glutamate C05834 3-Methyldioxyindole C05835 2-Formaminobenzoylacetate C05840 Iminoaspartate C05852 2-Hydroxyphenylacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05936 N4-Acetylaminobutanal C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05946 D-4-Hydroxy-2-oxoglutarate C05947 L-erythro-4-Hydroxyglutamate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06156 alpha-D-Glucosamine1-phosphate C06160 S-Norcoclaurine C06186 Arbutin C06187 Arbutin6-phosphate C06198 P1,P4-Bis5'-uridyltetraphosphate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06224 3,4-Dihydroxystyrene C06241 N-Acetylneuraminate9-phosphate C06244 Acetamide C06316 D-erythro-Ascorbate C06330 Quinoline-3,4-diol C06366 Homospermidine C06372 Lacto-N-biose C06393 2,3-Diaminopropanoate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06554 Cyanuricacid C06555 Biuret C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06655 L-N2-2-Carboxyethylarginine C06732 alpha,beta-Didehydrotryptophan C06746 N-Acetylphenylethylamine C06771 Triethanolamine C06772 Diethanolamine C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07086 Phenylaceticacid C07272 Maleimide C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11437 1-Deoxy-D-xylulose5-phosphate C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13635 4-Hydroxyphenacylalcohol C13636 4-Hydroxyphenylacetate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14096 3-Formylsalicylicacid C14097 2-Hydroxyisophthalicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15499 Pentane-2,4-dione C15523 2,6-Dihydroxynicotinate C15532 N-Acetyl-L-citrulline C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate C15668 1-Pyrroline C15767 gamma-Glutamyl-gamma-aminobutyraye C16074 Phenylacetonitrile C16075 Z-Phenylacetaldehydeoxime C16235 o-Hydroxylaminobenzoate Consensus scope of cluster 7 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00704 O2.- C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Consensus scope of cluster 8 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00011 CO2 C00013 Pyrophosphate C00022 Pyruvate C00027 H2O2 C00031 D-Glucose C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00067 Formaldehyde C00074 Phosphoenolpyruvate C00080 H+ C00084 Acetaldehyde C00085 D-Fructose6-phosphate C00089 Sucrose C00090 Catechol C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00095 D-Fructose C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00116 Glycerol C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00121 D-Ribose C00122 Fumarate C00132 Methanol C00137 myo-Inositol C00149 S-Malate C00158 Citrate C00159 D-Mannose C00160 Glycolate C00164 Acetoacetate C00168 Hydroxypyruvate C00184 Glycerone C00185 Cellobiose C00186 S-Lactate C00191 D-Glucuronate C00196 2,3-Dihydroxybenzoate C00197 3-Phospho-D-glycerate C00198 D-Glucono-1,5-lactone C00199 D-Ribulose5-phosphate C00204 2-Dehydro-3-deoxy-D-gluconate C00207 Acetone C00208 Maltose C00209 Oxalate C00216 D-Arabinose C00221 beta-D-Glucose C00222 3-Oxopropanoate C00227 Acetylphosphate C00230 3,4-Dihydroxybenzoate C00231 D-Xylulose5-phosphate C00236 3-Phospho-D-glyceroylphosphate C00237 CO C00252 Isomaltose C00256 R-Lactate C00257 D-Gluconicacid C00258 D-Glycerate C00266 Glycolaldehyde C00267 alpha-D-Glucose C00275 D-Mannose6-phosphate C00279 D-Erythrose4-phosphate C00281 Sedoheptulose7-phosphate C00309 D-Ribulose C00311 Isocitrate C00345 6-Phospho-D-gluconate C00354 D-Fructose1,6-bisphosphate C00392 Mannitol C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00447 D-Sedoheptulose1,7-bisphosphate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00514 D-Mannonate C00530 p-Benzenediol C00536 Triphosphate C00544 Homogentisate C00545 L-Arabinonate C00546 Methylglyoxal C00552 meso-Tartaricacid C00577 D-Glyceraldehyde C00596 2-Hydroxy-2,4-pentadienoate C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00628 2,5-Dihydroxybenzoate C00629 2-Dehydro-D-gluconate C00631 2-Phospho-D-glycerate C00636 D-Mannose1-phosphate C00642 4-Hydroxyphenylacetate C00644 D-Mannitol1-phosphate C00652 D-Arabinono-1,4-lactone C00660 D-Glucose1,6-bisphosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00689 alpha,alpha'-Trehalose6-phosphate C00704 O2.- C00711 Malate C00794 D-Sorbitol C00804 Propynoate C00810 R-Acetoin C00817 D-Altronate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00905 D-Fructuronate C00944 3-Dehydroquinate C00969 3-Hydroxypropanal C00975 Dihydroxyfumarate C00988 2-Phosphoglycolate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01094 D-Fructose1-phosphate C01096 Sorbitol6-phosphate C01101 L-Ribulose5-phosphate C01108 1,2,3-Trihydroxybenzene C01112 D-Arabinose5-phosphate C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01146 2-Hydroxy-3-oxopropanoate C01159 2,3-Bisphospho-D-glycerate C01163 3-Carboxy-cis,cis-muconate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01179 3-4-Hydroxyphenylpyruvate C01182 D-Ribulose1,5-bisphosphate C01187 3-Deoxy-D-manno-octulosonate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01231 alpha-D-Glucose1,6-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01742 Palatinose C01769 S-Acetoin C01990 3-Oxalomalate C02013 Cellotetraose C02048 Laminaribiose C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02336 beta-D-Fructose C02341 trans-Aconitate C02351 1,2-Benzoquinone C02466 Trimetaphosphate C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02591 Sucrose6-phosphate C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02655 6-Acetyl-D-glucose C02670 D-Glucuronolactone C02753 D-Xylono-1,4-lactone C02779 2-Dehydro-D-glucose C02798 3-Phosphonopyruvate C02923 2,3-Dihydroxytoluene C02964 D-Glucosyl-D-mannose C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03167 Phosphonoacetaldehyde C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03387 D-Glucurono-6,2-lactone C03394 Erythrulose1-phosphate C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03546 myo-Inositol4-phosphate C03548 trans-2,3-Epoxysuccinate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03661 1F-beta-D-Fructosylsucrose C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03736 alpha-D-Ribose5-phosphate C03765 4-Hydroxyphenylacetaldehyde C03785 D-Tagatose1,6-bisphosphate C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03947 Glycerol1,2-cyclicphosphate C03981 2-Hydroxyethylenedicarboxylate C04006 1D-myo-Inositol3-phosphate C04044 3-2,3-Dihydroxyphenylpropanoate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04299 D-myo-Inositol1,2-cyclicphosphate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C05345 beta-D-Fructose6-phosphate C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05378 beta-D-Fructose1,6-bisphosphate C05382 D-Sedoheptulose7-phosphate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05616 3-O-Methylgallate C05682 Phosphonoacetate C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C05999 Lactaldehyde C06010 S-2-Acetolactate C06019 D-arabino-3-Hexulose6-phosphate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06187 Arbutin6-phosphate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06316 D-erythro-Ascorbate C06440 2-Dehydro-D-glucono-1,5-lactone C06441 L-Xylulose1-phosphate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C07836 D-glycero-D-manno-Heptose7-phosphate C11437 1-Deoxy-D-xylulose5-phosphate C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C15499 Pentane-2,4-dione C15548 2-alpha-D-Glucosyl-D-glucose C15556 3,4-Dihydroxy-2-butanone4-phosphate Consensus scope of cluster 9 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00704 O2.- C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C03459 2-Hydroxy-3-oxosuccinate Consensus scope of cluster 10 C00001 H2O C00007 Oxygen C00010 CoA C00011 CO2 C00022 Pyruvate C00024 Acetyl-CoA C00027 H2O2 C00033 Acetate C00036 Oxaloacetate C00042 Succinate C00048 Glyoxylate C00058 Formate C00080 H+ C00083 Malonyl-CoA C00084 Acetaldehyde C00090 Catechol C00091 Succinyl-CoA C00100 Propanoyl-CoA C00109 2-Oxobutanoate C00122 Fumarate C00149 S-Malate C00158 Citrate C00160 Glycolate C00163 Propanoate C00164 Acetoacetate C00168 Hydroxypyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00207 Acetone C00209 Oxalate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00237 CO C00256 R-Lactate C00258 D-Glycerate C00266 Glycolaldehyde C00311 Isocitrate C00313 Oxalyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00383 Malonate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00472 p-Benzoquinone C00490 Itaconate C00497 R-Malate C00502 D-Xylonate C00511 Propenoate C00530 p-Benzenediol C00531 Itaconyl-CoA C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00566 3S-Citryl-CoA C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00642 4-Hydroxyphenylacetate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00683 S-2-Methyl-3-oxopropanoyl-CoA C00684 2-Dehydro-3-deoxy-L-arabinonate C00704 O2.- C00711 Malate C00798 Formyl-CoA C00804 Propynoate C00810 R-Acetoin C00815 Citramalate C00818 D-Glucarate C00827 Lactoyl-CoA C00846 3-Oxoadipate C00877 Crotonoyl-CoA C00878 D-Arabinonate C00879 D-Galactarate C00894 Propenoyl-CoA C00898 R,R-Tartaricacid C00900 2-Acetolactate C00904 Citramalyl-CoA C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C00975 Dihydroxyfumarate C00989 4-Hydroxybutanoicacid C01011 3S-Citramalyl-CoA C01013 3-Hydroxypropanoate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01144 S-3-Hydroxybutanoyl-CoA C01146 2-Hydroxy-3-oxopropanoate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01213 R-2-Methyl-3-oxopropanoyl-CoA C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01353 Carbonicacid C01384 Maleicacid C01424 Gallate C01548 Acetylene C01572 Digallate C01732 Mesaconate C01757 Triacetate C01769 S-Acetoin C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02170 Methylmalonate C02214 E-Glutaconate C02225 2-Methylcitrate C02226 2-Methylmaleate C02232 3-Oxoadipyl-CoA C02266 D-Xylonolactone C02295 Methylitaconate C02331 Vinylacetyl-CoA C02341 trans-Aconitate C02351 1,2-Benzoquinone C02411 Glutaconyl-1-CoA C02480 cis,cis-Muconate C02488 R-2-Ethylmalate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02557 Methylmalonyl-CoA C02612 R-2-Methylmalate C02614 S-2-Methylmalate C02630 2-Hydroxyglutarate C02637 3-Dehydroshikimate C02752 Triacetatelactone C02753 D-Xylono-1,4-lactone C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C03058 2-Hydroxyglutaryl-CoA C03223 3,4-Dihydroxyphthalate C03231 3-Methylglutaconyl-CoA C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03344 2-Methylacetoacetyl-CoA C03453 Z-5-Oxohex-2-enedioate C03459 2-Hydroxy-3-oxosuccinate C03548 trans-2,3-Epoxysuccinate C03561 R-3-Hydroxybutanoyl-CoA C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03761 3-Hydroxy-3-methylglutarate C03765 4-Hydroxyphenylacetaldehyde C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C05116 3-Hydroxybutanoyl-CoA C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05668 3-Hydroxypropionyl-CoA C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C06029 L-threo-3-Methylmalate C06030 Methyloxaloacetate C06031 D-threo-3-Methylmalate C06032 D-erythro-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06144 3-Butynoate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06603 cis,trans-4-Hydroxymuconicsemialdehyde C06719 Dihydrophloroglucinol C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C11062 4-Hydroxybutyryl-CoA C11527 4-Hydroxymandelate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C13636 4-Hydroxyphenylacetate C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16268 Cyclopropanecarboxyl-CoA C16272 3-Hydroxy-5-oxohexanoate C16273 3-Hydroxy-5-oxohexanoyl-CoA C16390 S-2-Hydroxymethylglutarate Consensus scope of cluster 11 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00282 Hydrogen C00704 O2.- C05421 15-cis-Phytoene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15867 3,4-Dehydrolycopene C15870 Rhodopin C15907 1',2'-Dihydro-gamma-carotene C16276 epsilon-Carotene Consensus scope of cluster 12 C00001 H2O C00007 Oxygen C00009 Orthophosphate C00013 Pyrophosphate C00027 H2O2 C00080 H+ C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C00521 --Limonene C00536 Triphosphate C00704 O2.- C01230 all-trans-Hexaprenyldiphosphate C01390 Prenol C01414 Casbene C01841 Pentalenene C01860 Trichodiene C02004 Aristolochene C02344 --endo-Fenchol C02462 Sabinenehydrate C02466 Trimetaphosphate C02569 Neryldiphosphate C03190 +-Bornyl-diphosphate C04216 all-trans-Heptaprenyldiphosphate C04217 all-trans-Pentaprenyldiphosphate C04509 di-trans,poly-cis-Decaprenyldiphosphate C04574 di-trans,poly-cis-Undecaprenyldiphosphate C06074 Myrcene C06075 Terpinolene C06086 Pimaradiene C06089 ent-Copalyldiphosphate C06090 ent-Kaurene C06099 +-Limonene C06111 Nerolidyldiphosphate C06307 --beta-Pinene C06308 --alpha-Pinene C06394 +-delta-Cadinene C11356 trans,trans,cis-Geranylgeranyldiphosphate C11388 --Linalool C11389 +-Linalool C11877 +-Sandaracopimaradiene C11878 --Abietadiene C11879 Levopimaradiene C11880 Neoabietadiene C11881 Palustradiene C11894 Taxa-45,1112-diene C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate C12142 Vetispiradiene C16028 Amorpha-4,11-diene C16141 +-GermacreneA C16142 --GermacreneD C16143 1E,4S,5E,7R-Germacra-110,5-dien-11-ol C16269 epi-Isozizaene Consensus scope of cluster 13 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00704 O2.- C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran Consensus scope of cluster 14 C00001 H2O C00007 Oxygen C00011 CO2 C00027 H2O2 C00048 Glyoxylate C00058 Formate C00072 Ascorbate C00080 H+ C00160 Glycolate C00168 Hydroxypyruvate C00209 Oxalate C00237 CO C00266 Glycolaldehyde C00425 Dehydroascorbate C00704 O2.- C00800 L-Gulonate C00975 Dihydroxyfumarate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01115 L-Galactono-1,4-lactone C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01620 Threonate C03289 L-xylo-Hexulonolactone C03459 2-Hydroxy-3-oxosuccinate C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05411 L-Xylonate C05412 L-Lyxonate C05422 L-Dehydroascorbate C15930 L-Galactonate Consensus scope of cluster 15 C00001 H2O C00007 Oxygen C00027 H2O2 C00080 H+ C00704 O2.- C01226 12-OPDA C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C06427 9Z,12Z,15Z-Octadecatrienoicacid C16309 Traumatin C16310 3-Hexenal C16311 12-Oxo-9Z-dodecenoicacid C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16322 9-Oxononanoicacid C16323 3,6-Nonadienal C16324 9,10-EOT C16325 10-OPDA datasetS2/strict/hierarchical_clusters.txt0000644000175000017500000006021010747436025020714 0ustar oliveroliverMetabolites in cluster 1: C00021 S-Adenosyl-L-homocysteine C00025 L-Glutamate C00037 Glycine C00041 L-Alanine C00047 L-Lysine C00049 L-Aspartate C00051 Glutathione C00062 L-Arginine C00064 L-Glutamine C00065 L-Serine C00073 L-Methionine C00077 L-Ornithine C00078 L-Tryptophan C00079 L-Phenylalanine C00082 L-Tyrosine C00086 Urea C00097 L-Cysteine C00106 Uracil C00108 Anthranilate C00127 Glutathionedisulfide C00133 D-Alanine C00135 L-Histidine C00147 Adenine C00152 L-Asparagine C00155 L-Homocysteine C00170 5'-Methylthioadenosine C00179 Agmatine C00188 L-Threonine C00212 Adenosine C00213 Sarcosine C00217 D-Glutamate C00242 Guanine C00262 Hypoxanthine C00270 N-Acetylneuraminate C00292 Aniline C00294 Inosine C00295 Orotate C00299 Uridine C00300 Creatine C00327 L-Citrulline C00328 L-Kynurenine C00337 S-Dihydroorotate C00355 3,4-Dihydroxy-L-phenylalanine C00366 Urate C00380 Cytosine C00385 Xanthine C00386 Carnosine C00387 Guanosine C00402 D-Aspartate C00407 L-Isoleucine C00429 5,6-Dihydrouracil C00430 5-Aminolevulinate C00436 N-Carbamoylputrescine C00437 N-Acetylornithine C00438 N-Carbamoyl-L-aspartate C00439 N-Formimino-L-glutamate C00475 Cytidine C00491 L-Cystine C00499 Allantoate C00515 D-Ornithine C00542 Cystathionine C00568 4-Aminobenzoate C00581 Guanidinoacetate C00603 --Ureidoglycolate C00606 3-Sulfino-L-alanine C00632 3-Hydroxyanthranilate C00643 5-Hydroxy-L-tryptophan C00666 LL-2,6-Diaminoheptanedioate C00669 gamma-L-Glutamyl-L-cysteine C00680 meso-2,6-Diaminoheptanedioate C00716 Serine C00739 D-Lysine C00740 D-Serine C00785 Urocanate C00791 Creatinine C00792 D-Arginine C00793 D-Cysteine C00813 Barbiturate C00819 D-Glutamine C00820 D-Threonine C00822 Dopaquinone C00826 L-Arogenate C00855 D-Methionine C00884 Homocarnosine C00906 5,6-Dihydrothymine C00916 CephalosporinC C00921 Dihydropteroate C00931 Porphobilinogen C00940 2-Oxoglutaramate C00977 L-Tryptophanamide C00993 D-Alanyl-D-alanine C01010 Urea-1-carboxylate C01020 6-Hydroxynicotinate C01026 N,N-Dimethylglycine C01031 S-Formylglutathione C01035 4-Guanidinobutanoate C01042 N-Acetyl-L-aspartate C01043 N-Carbamoylsarcosine C01044 N-Formyl-L-aspartate C01045 N-Formyl-L-glutamate C01047 N5-Ethyl-L-glutamine C01059 2,5-Dihydroxypyridine C01060 3,5-Diiodo-L-tyrosine C01118 O-Succinyl-L-homoserine C01142 3S-3,6-Diaminohexanoate C01157 trans-4-Hydroxy-L-proline C01162 3-Pyrazol-1-yl-L-alanine C01186 3S,5S-3,5-Diaminohexanoate C01215 2-Acetamidomethylenesuccinate C01234 1-Aminocyclopropane-1-carboxylate C01259 3-Hydroxy-N6,N6,N6-trimethyl-L-lysine C01417 Cyanate C01419 Cys-Gly C01537 Urethane C01551 Allantoin C01563 Carbamate C01566 Cyanamide C01586 Hippurate C01596 Maleamate C01762 Xanthosine C01921 Glycocholate C01993 5'-Oxoinosine C02091 Ureidoglycine C02166 LeukotrieneC4 C02218 2-Aminoacrylate C02220 2-Aminomuconate C02237 5-Oxo-D-proline C02253 Benzoylagmatine C02291 L-Cystathionine C02294 Methylguanidine C02348 R--Allantoin C02350 S+-Allantoin C02362 2-Oxosuccinamate C02512 3-Cyano-L-alanine C02564 N-Feruloylglycine C02642 3-Ureidopropionate C02693 Indole-3-acetamide C02700 L-Formylkynurenine C02703 L-SerineO-sulfate C02727 N6-Acetyl-L-lysine C02728 N6-Methyl-L-lysine C02775 2,3-Dihydroxyindole C02837 L-Lysine1,6-lactam C02937 3-Indoleacetaldoxime C02938 3-Indoleacetonitrile C02999 N-Acetylmuramoyl-Ala C03015 O-Carbamoyl-L-serine C03030 Uracil5-carboxylate C03047 1,4-Diguanidinobutane C03065 3-Guanidinopropanoate C03078 4-Guanidinobutanamide C03139 N-Amidino-L-aspartate C03145 N-Formyl-L-methionine C03174 S-Succinylglutathione C03227 3-Hydroxy-L-kynurenine C03283 L-2,4-Diaminobutanoate C03290 L-threo-3-Phenylserine C03296 N2-Succinyl-L-arginine C03406 N-L-Argininosuccinate C03409 N-Formimino-L-aspartate C03440 cis-4-Hydroxy-D-proline C03451 R-S-Lactoylglutathione C03508 L-2-Amino-3-oxobutanoicacid C03539 S-Ribosyl-L-homocysteine C03618 L-threo-3-Methylaspartate C03623 N-Methyl-2-oxoglutaramate C03626 NG,NG-Dimethyl-L-arginine C03680 4-Imidazolone-5-propanoate C03703 L-5-Carboxymethylhydantoin C03708 N-Acetyl-O-acetylneuraminate C03710 N-Benzyloxycarbonylglycine C03722 Pyridine-2,3-dicarboxylate C03741 S-4-Amino-5-oxopentanoate C03771 5-Guanidino-2-oxopentanoate C03943 2R,4S-2,4-Diaminopentanoate C03961 erythro-3-Hydroxy-L-aspartate C04079 N-R-Pantothenoyl-L-cysteine C04282 1-Pyrroline-4-hydroxy-2-carboxylate C04368 3-Amino-3-4-hydroxyphenylpropanoate C04390 N6-Acetyl-LL-2,6-diaminoheptanedioate C04409 2-Amino-3-carboxymuconatesemialdehyde C04421 N-Succinyl-LL-2,6-diaminoheptanedioate C04540 N4-Acetyl-beta-D-glucosaminylasparagine C04584 6-Imino-5-oxocyclohexa-1,3-dienecarboxylate C04690 2-Hydroxymethyl-3-acetamidomethylenesuccinate C04771 S-2-Amino-3-3-hydroxy-4-oxo-4H-pyridin-1-ylpropanoate C04776 D-Galactosyl-3-N-acetyl-beta-D-galactosaminyl-L-serine C04796 4-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C04797 5-L-Alanin-3-yl-2-hydroxy-cis,cis-muconate6-semialdehyde C05100 3-Ureidoisobutyrate C05133 4-Imidazolone-5-acetate C05161 2,5-Diaminohexanoate C05328 D-2-Amino-hexano-6-lactam C05335 Selenomethionine C05341 beta-Alanyl-L-lysine C05380 Nicotinurate C05464 Glycodeoxycholate C05466 Glycochenodeoxycholate C05515 5-Ureido-4-imidazolecarboxylate C05516 5-Amino-4-imidazolecarboxylate C05519 L-Allothreonine C05520 2-Amino-3-oxoadipate C05552 N6-D-Biotinyl-L-lysine C05565 Hydantoin-5-propionate C05572 4-Oxoglutaramate C05648 5-Hydroxy-N-formylkynurenine C05651 5-Hydroxykynurenine C05653 Formylanthranilate C05692 Se-Adenosylselenohomocysteine C05699 Selenocystathionine C05711 gamma-Glutamyl-beta-cyanoalanine C05730 Glutathionylspermidine C05829 N-Carbamyl-L-glutamate C05837 Glucobrassicin C05840 Iminoaspartate C05931 N-Succinyl-L-glutamate C05935 2-Oxoarginine C05941 2-Oxo-4-hydroxy-5-aminovalerate C05942 Pyrrole-2-carboxylate C05951 LeukotrieneD4 C06330 Quinoline-3,4-diol C06381 Methylenediurea C06382 N-Carboxyaminomethylurea C06393 2,3-Diaminopropanoate C06462 LeukotrieneF4 C06551 Atrazine C06552 Hydroxyatrazine C06553 N-Isopropylammelide C06554 Cyanuricacid C06555 Biuret C06556 Deisopropylatrazine C06557 Deisopropylhydroxyatrazine C06558 2,4-Dihydroxy-6-N'-ethylamino-1,3,5-triazine C06559 Deethylatrazine C06560 Deisopropyldeethylatrazine C06657 Guanidinoproclavaminicacid C06673 4-Carboxy-4'-sulfoazobenzene C06732 alpha,beta-Didehydrotryptophan C06751 Prenyl-L-cysteine C07272 Maleimide C08061 2'-Aminobiphenyl-2,3-diol C08062 2-Hydroxy-6-oxo-2'-aminophenyl-hexa-2,4-dienoate C08733 2-Hydroxy-4,6-diamino-1,3,5-triazine C08734 2,4-Dihydroxy-6-amino-1,3,5-triazine C08735 2-Chloro-4-hydroxy-6-amino-1,3,5-triazine C08737 Melamine C11355 4-Amino-4-deoxychorismate C11500 5'-Dehydroadenosine C11503 3-Hydroxy-1H-quinolin-4-one C11511 threo-3-Hydroxy-L-aspartate C11821 5-Hydroxyisourate C12248 5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate C12989 N2-Acetyl-L-lysine C14147 Cyromazine C14148 N-Cyclopropylammeline C14149 N-Cyclopropylammelide C14180 S-Hydroxymethylglutathione C14419 2,4-Dichloroaniline C14450 4-Chloroaniline C14791 1R-Hydroxy-2R-glutathionyl-1,2-dihydronaphthalene C14792 1S-Hydroxy-2S-glutathionyl-1,2-dihydronaphthalene C14793 1R-Glutathionyl-2R-hydroxy-1,2-dihydronaphthalene C14803 1-Nitro-7-hydroxy-8-glutathionyl-7,8-dihydronaphthalene C14804 1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene C14805 1-Nitro-5-hydroxy-6-glutathionyl-5,6-dihydronaphthalene C14806 1-Nitro-5-glutathionyl-6-hydroxy-5,6-dihydronaphthalene C14847 3,4-Dihydro-3-hydroxy-4-S-glutathionylbromobenzene C14848 2,3-Dihydro-2-S-glutathionyl-3-hydroxybromobenzene C14855 4,5-Dihydro-4-hydroxy-5-S-glutathionyl-benzoapyrene C14856 7,8-Dihydro-7-hydroxy-8-S-glutathionyl-benzoapyrene C14861 S-2,2-Dichloro-1-hydroxyethylglutathione C14863 2-S-Glutathionylacetylglutathione C15523 2,6-Dihydroxynicotinate C15607 3-Oxo-3-ureidopropanoate C15767 gamma-Glutamyl-gamma-aminobutyraye C16235 o-Hydroxylaminobenzoate Metabolites in cluster 2: C00022 Pyruvate C00036 Oxaloacetate C00090 Catechol C00122 Fumarate C00149 S-Malate C00158 Citrate C00166 Phenylpyruvate C00186 S-Lactate C00196 2,3-Dihydroxybenzoate C00222 3-Oxopropanoate C00230 3,4-Dihydroxybenzoate C00251 Chorismate C00254 Prephenate C00256 R-Lactate C00311 Isocitrate C00417 cis-Aconitate C00433 2,5-Dioxopentanoate C00497 R-Malate C00502 D-Xylonate C00544 Homogentisate C00545 L-Arabinonate C00552 meso-Tartaricacid C00596 2-Hydroxy-2,4-pentadienoate C00628 2,5-Dihydroxybenzoate C00652 D-Arabinono-1,4-lactone C00679 5-Dehydro-4-deoxy-D-glucarate C00682 2-Hydroxymuconatesemialdehyde C00684 2-Dehydro-3-deoxy-L-arabinonate C00804 Propynoate C00818 D-Glucarate C00846 3-Oxoadipate C00878 D-Arabinonate C00879 D-Galactarate C00885 Isochorismate C00898 R,R-Tartaricacid C00900 2-Acetolactate C00922 2,3-Dimethylmaleate C00944 3-Dehydroquinate C01036 4-Maleylacetoacetate C01061 4-Fumarylacetoacetate C01108 1,2,3-Trihydroxybenzene C01114 L-Arabinono-1,4-lactone C01127 4-Hydroxy-2-oxoglutarate C01163 3-Carboxy-cis,cis-muconate C01179 3-4-Hydroxyphenylpyruvate C01187 3-Deoxy-D-manno-octulosonate C01273 2-Hydroxy-6-oxo-6-phenylhexa-2,4-dienoate C01275 3E-4-2-Carboxyphenyl-2-oxobut-3-enoate C01278 2-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C01384 Maleicacid C01424 Gallate C01572 Digallate C01680 D-Fuconate C01732 Mesaconate C01934 L-Rhamnonate C01990 3-Oxalomalate C02107 S,S-Tartaricacid C02132 Acetylpyruvate C02167 Maleylpyruvate C02225 2-Methylcitrate C02266 D-Xylonolactone C02295 Methylitaconate C02341 trans-Aconitate C02351 1,2-Benzoquinone C02375 4-Chlorocatechol C02480 cis,cis-Muconate C02501 2-Hydroxymuconate C02514 3-Fumarylpyruvate C02526 Biphenyl-2,3-diol C02614 S-2-Methylmalate C02637 3-Dehydroshikimate C02753 D-Xylono-1,4-lactone C02763 enol-Phenylpyruvate C02914 S-2-O-Sulfolactate C02923 2,3-Dihydroxytoluene C02930 2-Methyleneglutarate C02991 L-Rhamnono-1,4-lactone C03063 2-Oxohept-3-enedioate C03071 3-aci-Nitropropanoate C03164 Phenanthrene-3,4-diol C03203 1-Hydroxy-2-naphthoate C03223 3,4-Dihydroxyphthalate C03233 4,5-Dihydroxyphthalate C03248 Acetylenedicarboxylate C03340 L-2,3-Dihydrodipicolinate C03453 Z-5-Oxohex-2-enedioate C03548 trans-2,3-Epoxysuccinate C03569 2,2',3-Trihydroxybiphenyl C03572 2-Chloro-cis,cis-muconate C03585 3-Chloro-cis,cis-muconate C03586 2-Oxo-2,3-dihydrofuran-5-acetate C03589 4-Hydroxy-2-oxopentanoate C03600 Carboxymethyloxysuccinate C03652 2R,3S-2,3-Dimethylmalate C03666 2-Carboxy-cis,cis-muconate C03671 2-Pyrone-4,6-dicarboxylate C03716 Oxaloacetate4-methylester C03826 2-Dehydro-3-deoxy-D-xylonate C03861 Dibenzo1,4dioxin-2,3-dione C03921 2-Dehydro-3-deoxy-D-glucarate C03979 2-Dehydro-3-deoxy-L-rhamnonate C03981 2-Hydroxyethylenedicarboxylate C04044 3-2,3-Dihydroxyphenylpropanoate C04052 5-Carboxy-2-oxohept-3-enedioate C04105 2,5-Dihydro-5-oxofuran-2-acetate C04112 3-Methyl-cis,cis-hexadienedioate C04115 4-Carboxy-4-hydroxy-2-oxoadipate C04181 3-Hydroxy-3-methyl-2-oxobutanoicacid C04186 5-Carboxymethyl-2-hydroxymuconate C04225 Z-But-2-ene-1,2,3-tricarboxylate C04324 4-Carboxy-2-hydroxy-cis,cis-muconate C04434 E-4-Oxobut-1-ene-1,2,4-tricarboxylate C04451 4-Carboxy-2-hydroxyhexa-2,4-dienedioate C04479 2-Hydroxy-6-oxonona-2,4-diene-1,9-dioate C04480 3-Carboxy-2-hydroxymuconatesemialdehyde C04484 4-Carboxy-2-hydroxymuconatesemialdehyde C04522 2-Chloro-2,5-dihydro-5-oxofuran-2-acetate C04553 3-Carboxy-2,5-dihydro-5-oxofuran-2-acetate C04558 4-Carboxymethyl-3-methylbut-2-en-1,4-olide C04559 4-Carboxymethyl-4-methylbut-2-en-1,4-olide C04593 2S,3R-3-Hydroxybutane-1,2,3-tricarboxylate C04823 1-5'-Phosphoribosyl-5-amino-4-N-succinocarboxamide-imidazole C05350 2-Hydroxy-3-4-hydroxyphenylpropenoate C05364 4-Carboxy-2-oxo-3-hexenedioate C05375 2-Hydroxy-2-hydropyrone-4,6-dicarboxylate C05405 L-Arabinono-1,5-lactone C05585 Gentisatealdehyde C05600 2-Hydroxyhepta-2,4-dienedioate C05601 4-Hydroxy-2-oxo-heptanedioate C05616 3-O-Methylgallate C05618 3-Chlorocatechol C05854 4-Carboxy-2-oxo-4-pentanoate C05946 D-4-Hydroxy-2-oxoglutarate C06010 S-2-Acetolactate C06029 L-threo-3-Methylmalate C06033 Parapyruvate C06035 4-Methylene-2-oxoglutarate C06159 2-Dehydro-3-deoxy-D-fuconate C06201 2,4-Dihydroxyhept-2-enedioate C06210 2-Hydroxy-6-keto-2,4-heptadienoate C06316 D-erythro-Ascorbate C06336 3-Sulfocatechol C06580 2,3-Dihydroxy-p-cumate C06581 2-Hydroxy-3-carboxy-6-oxo-7-methylocta-2,4-dienoate C06582 2-Hydroxy-6-oxo-7-methylocta-2,4-dienoate C06586 2,3-Dihydroxy-4'-chlorobiphenyl C06587 2-Hydroxy-6-oxo-6-4'-chlorophenyl-hexa-2,4-dienoate C06609 trans-1,3-Dichloropropene C06610 cis-1,3-Dichloropropene C06611 trans-3-Chloro-2-propene-1-ol C06612 cis-3-Chloro-2-propene-1-ol C06613 3-Chloroallylaldehyde C06614 trans-3-Chloroacrylicacid C06615 cis-3-Chloroacrylicacid C06712 Fluoren-9-one C06730 4-Methylcatechol C06760 2-Hydroxy-5-methyl-cis,cis-muconicsemialdehyde C06761 4E-2-Oxohexenoicacid C06762 4-Hydroxy-2-oxohexanoicacid C06813 Nitrobenzene C07085 3-Vinylcatechol C07087 2-Hydroxy-6-oxoocta-2,4,7-trienoate C07089 5-Chloro-2-hydroxymuconicsemialdehyde C07478 2-Hydroxy-5-methyl-cis,cis-muconate C07479 2-Oxo-5-methyl-cis-muconate C07717 3,4-Dihydroxyfluorene C07718 2-Hydroxy-4-1-oxo-1,3-dihydro-2H-inden-2-ylidene-but-2-enoicacid C07721 +-3S,4R-cis-3,4-Dihydroxy-3,4-dihydrofluorene C07724 1,2-Dihydroxyfluorene C07725 2-Hydroxy-4-2-oxo-1,3-dihydro-2H-inden-1-ylidenebut-2-enoicacid C07731 2-Hydroxy-6-oxo-6-2-hydroxyphenyl-hexa-2,4-dienoate C07733 2,2',3-Trihydroxydiphenylether C07734 2-Hydroxy-6-oxo-6-2-hydroxyphenoxy-hexa-2,4-dienoate C09816 Benzylsuccinate C11354 2-Hydroxy-cis-hex-2,4-dienoate C11425 2-Hydroxy-2H-benzohchromene-2-carboxylate C11426 cis-4-1'-Hydroxynaphth-2'-yl-2-oxobut-3-enoate C12623 trans-2,3-Dihydroxycinnamate C12624 2-Hydroxy-6-ketononatrienedioate C14084 1,2-Dihydroxy-8-methylnaphthalene C14085 2-Hydroxy-8-methylchromene-2-carboxylate C14086 2-Hydroxy-3-methylbenzalpyruvate C14093 1,2-Dihydroxy-8-carboxynaphthalene C14094 2-Carboxy-2-hydroxy-8-carboxychromene C14095 2-Hydroxy-3-carboxybenzalpyruvate C14105 1,2-Dihydroxy-7-hydroxymethylnaphthalene C14106 2-Hydroxy-7-hydroxymethylchromene-2-carboxylate C14107 2-Hydroxy-4-hydroxymethylbenzalpyruvate C14115 Naphthyl-2-methyl-succinicacid C14610 S-5-Oxo-2,5-dihydrofuran-2-acetate C16149 3Z-4-2-Carboxyphenyl-2-oxobut-3-enoate C16199 5-Sulfosalicylate C16204 1,2-Anthracenediol C16209 3-2-Carboxyvinylnaphthalene-2-carboxylicacid C16210 4-3-Hydroxy-2-naphthyl-2-oxobut-3-enoicacid C16262 1-Hydro-1,1a-dihydroxy-9-fluorenone C16263 2,3-Dihydroxy-2'-carboxybiphenyl C16264 2-Hydroxy-6-oxo-6-2-carboxyphenyl-hexa-2,4-dienoate C16266 3-Chloro-2-hydroxymuconicsemialdehyde C16348 cis-3-Chloroallylaldehyde C16390 S-2-Hydroxymethylglutarate Metabolites in cluster 3: C00085 D-Fructose6-phosphate C00092 D-Glucose6-phosphate C00093 sn-Glycerol3-phosphate C00103 D-Glucose1-phosphate C00111 Glyceronephosphate C00117 D-Ribose5-phosphate C00118 2R-2-Hydroxy-3-phosphonooxy-propanal C00199 D-Ribulose5-phosphate C00231 D-Xylulose5-phosphate C00275 D-Mannose6-phosphate C00352 D-Glucosamine6-phosphate C00354 D-Fructose1,6-bisphosphate C00357 N-Acetyl-D-glucosamine6-phosphate C00447 D-Sedoheptulose1,7-bisphosphate C00455 NicotinamideD-ribonucleotide C00620 alpha-D-Ribose1-phosphate C00623 Glycerol1-phosphate C00636 D-Mannose1-phosphate C00644 D-Mannitol1-phosphate C00663 beta-D-Glucose1-phosphate C00665 beta-D-Fructose2,6-bisphosphate C00668 alpha-D-Glucose6-phosphate C00670 sn-glycero-3-Phosphocholine C00689 alpha,alpha'-Trehalose6-phosphate C01094 D-Fructose1-phosphate C01099 L-Fuculose1-phosphate C01101 L-Ribulose5-phosphate C01112 D-Arabinose5-phosphate C01131 L-Rhamnulose1-phosphate C01172 beta-D-Glucose6-phosphate C01177 Inositol1-phosphate C01220 1D-myo-Inositol1,4-bisphosphate C01225 sn-glycero-3-Phospho-1-inositol C01243 1D-myo-Inositol1,3,4-trisphosphate C01245 D-myo-Inositol1,4,5-trisphosphate C01272 1D-myo-Inositol1,3,4,5-tetrakisphosphate C02591 Sucrose6-phosphate C02979 Glycerol2-phosphate C02995 Maltose6'-phosphate C03267 beta-D-Fructose2-phosphate C03291 L-Xylulose5-phosphate C03394 Erythrulose1-phosphate C03506 Indoleglycerolphosphate C03546 myo-Inositol4-phosphate C03736 alpha-D-Ribose5-phosphate C03785 D-Tagatose1,6-bisphosphate C03947 Glycerol1,2-cyclicphosphate C04006 1D-myo-Inositol3-phosphate C04062 D-myo-Inositol1,3-bisphosphate C04063 D-myo-Inositol3,4-bisphosphate C04256 N-Acetyl-D-glucosamine1-phosphate C04257 N-Acetyl-D-mannosamine6-phosphate C04299 D-myo-Inositol1,2-cyclicphosphate C04534 6-Phospho-beta-D-glucosyl-1,4-D-glucose C04645 6-D-Glucose-1-phospho-D-mannosylglycoprotein C05345 beta-D-Fructose6-phosphate C05378 beta-D-Fructose1,6-bisphosphate C05396 Lactose6-phosphate C06019 D-arabino-3-Hexulose6-phosphate C06156 alpha-D-Glucosamine1-phosphate C06187 Arbutin6-phosphate C06188 Salicin6-phosphate C06441 L-Xylulose1-phosphate Metabolites in cluster 4: C00002 ATP C00008 ADP C00016 FAD C00020 AMP C00035 GDP C00044 GTP C00053 3'-Phosphoadenylylsulfate C00054 Adenosine3',5'-bisphosphate C00081 ITP C00096 GDP-mannose C00104 IDP C00130 IMP C00144 GMP C00224 Adenylylsulfate C00286 dGTP C00301 ADP-ribose C00360 dAMP C00362 dGMP C00394 GDP-glucose C00498 ADP-glucose C00575 3',5'-CyclicAMP C00655 Xanthosine5'-phosphate C00700 XTP C00942 3',5'-CyclicGMP C01201 Nomega-ADP-D-ribosyl-L-arginine C01222 GDP-4-dehydro-6-deoxy-D-mannose C01228 Guanosine3',5'-bisdiphosphate C01260 P1,P4-Bis5'-adenosyltetraphosphate C01261 P1,P4-Bis5'-guanosyltetraphosphate C01367 3'-AMP C02280 GDP-L-galactose C02353 2',3'-CyclicAMP C02739 Phosphoribosyl-ATP C03483 Adenosinetetraphosphate C03614 Inosine5'-tetraphosphate C03794 N6-1,2-Dicarboxyethyl-AMP C04307 P1,P2-Bis5'-adenosyltriphosphate C04392 P1,P4-Bis5'-xanthosyltetraphosphate C04494 Guanosine3'-diphosphate5'-triphosphate C04734 1-5'-Phosphoribosyl-5-formamido-4-imidazolecarboxamide C05922 Formamidopyrimidinenucleosidetriphosphate C05993 Acetyladenylate C06192 ADP-mannose C06193 Guanosine3'-phosphate C06194 2',3'-CyclicGMP C06197 P1,P3-Bis5'-adenosyltriphosphate C06433 5'-Benzoylphosphoadenosine C06435 5'-Butyrylphosphoinosine C14830 GDP-4-keto-6-L-deoxygalactose C15925 GDP-L-gulose Metabolites in cluster 5: C00031 D-Glucose C00089 Sucrose C00095 D-Fructose C00159 D-Mannose C00185 Cellobiose C00198 D-Glucono-1,5-lactone C00204 2-Dehydro-3-deoxy-D-gluconate C00208 Maltose C00221 beta-D-Glucose C00252 Isomaltose C00257 D-Gluconicacid C00267 alpha-D-Glucose C00329 D-Glucosamine C00392 Mannitol C00514 D-Mannonate C00629 2-Dehydro-D-gluconate C00761 Coniferin C00817 D-Altronate C00844 R-Prunasin C01083 alpha,alpha-Trehalose C01093 Cellobiono-1,5-lactone C01158 1-O-Galloyl-beta-D-glucose C01533 Syringin C01742 Palatinose C01982 R-Amygdalin C02013 Cellotetraose C02074 Raucaffricine C02655 6-Acetyl-D-glucose C02779 2-Dehydro-D-glucose C02964 D-Glucosyl-D-mannose C03752 2-Amino-2-deoxy-D-gluconate C03855 Cholesteryl-beta-D-glucoside C03915 1-O-Sinapoylbeta-D-glucoside C04218 alpha,alpha'-Trehalose6-mycolate C05158 trans-beta-D-Glucosyl-2-hydroxycinnamate C05403 3-Ketolactose C05839 cis-beta-D-Glucosyl-2-hydroxycinnamate C05855 4-Hydroxycinnamylalcohol4-D-glucoside C06046 Salidroside C06216 Celloheptaose C06217 Cellohexaose C06218 Cellopentaose C06219 Cellotriose C06440 2-Dehydro-D-glucono-1,5-lactone Metabolites in cluster 6: C00015 UDP C00029 UDP-glucose C00043 UDP-N-acetyl-D-glucosamine C00052 UDP-D-galactose C00055 CMP C00063 CTP C00075 UTP C00105 UMP C00112 CDP C00203 UDP-N-acetyl-D-galactosamine C00239 dCMP C00365 dUMP C00458 dCTP C00460 dUTP C00513 CDP-glycerol C00705 dCDP C01005 O-Phospho-L-serine C01102 O-Phospho-L-homoserine C01103 Orotidine5'-phosphate C01168 Pseudouridine5'-phosphate C01170 UDP-N-acetyl-D-mannosamine C01233 sn-glycero-3-Phosphoethanolamine C01302 1-2-Carboxyphenylamino-1'-deoxy-D-ribulose5'-phosphate C01368 3'-UMP C02305 Phosphocreatine C02354 2',3'-CyclicCMP C02355 2',3'-CyclicUMP C02532 D-O-Phosphoserine C03733 UDP-alpha-D-galacto-1,4-furanose C03872 L-Serine-phosphoethanolamine C04089 UDP-4-dehydro-6-deoxy-D-glucose C04302 N-5-Phospho-D-ribosylanthranilate C04652 UDP-2,3-bis3-hydroxytetradecanoylglucosamine C05672 2-Amino-3-phosphonopropanoate C05822 3'-CMP C06198 P1,P4-Bis5'-uridyltetraphosphate C06241 N-Acetylneuraminate9-phosphate C11436 2-Phospho-4-cytidine5'-diphospho-2-C-methyl-D-erythritol C11521 UDP-6-sulfoquinovose Metabolites in cluster 7: C00219 5Z,8Z,11Z,14Z-Icosatetraenoicacid C00427 ProstaglandinH2 C00584 ProstaglandinE2 C00696 5Z,13E-15S-9alpha,15-Dihydroxy-11-oxoprosta-5,13-dienoate C00909 LeukotrieneA4 C01312 ProstaglandinI2 C02165 LeukotrieneB4 C02198 ThromboxaneA2 C04822 8R-HPETE C05356 5S-HPETE C05953 ProstaglandinA2 C05954 ProstaglandinB2 C05955 ProstaglandinC2 C05956 ProstaglandinG2 C05957 ProstaglandinJ2 C05958 delta-12-ProstaglandinJ2 C05959 11-epi-ProstaglandinF2alpha C05961 6-Keto-prostaglandinF1alpha C05963 ThromboxaneB2 C05965 12S-HPETE C05966 15S-HPETE C14717 15-Deoxy-delta-12,14-PGJ2 C14781 15H-11,12-EETA C14782 11,12,15-THETA C14808 HepoxilinA3 C14809 TrioxilinA3 C14810 HepoxilinB3 C14811 TrioxilinB3 C14812 12R-HPETE C14813 11H-14,15-EETA C14814 11,14,15-THETA C14820 11R-HPETE C14821 9S-HPETE C14823 8S-HPETE Metabolites in cluster 8: C00074 Phosphoenolpyruvate C00197 3-Phospho-D-glycerate C00236 3-Phospho-D-glyceroylphosphate C00345 6-Phospho-D-gluconate C00363 dTDP C00364 dTMP C00459 dTTP C00631 2-Phospho-D-glycerate C00672 2-Deoxy-D-ribose1-phosphate C00673 2-Deoxy-D-ribose5-phosphate C01159 2,3-Bisphospho-D-glycerate C01182 D-Ribulose1,5-bisphosphate C01236 D-Glucono-1,5-lactone6-phosphate C01269 5-O-1-Carboxyvinyl-3-phosphoshikimate C01286 2-Dehydro-3-deoxy-D-galactonate6-phosphate C02798 3-Phosphonopyruvate C04442 2-Dehydro-3-deoxy-6-phospho-D-gluconate C04456 6-Phospho-5-dehydro-2-deoxy-D-gluconate C04478 3-Deoxy-D-manno-octulosonate8-phosphate C04691 2-Dehydro-3-deoxy-D-arabino-heptonate7-phosphate C06893 2-Deoxy-5-keto-D-gluconicacid6-phosphate C11536 2R-O-Phospho-3-sulfolactate C12106 AminoDAHP Metabolites in cluster 9: C00011 CO2 C00019 S-Adenosyl-L-methionine C00048 Glyoxylate C00160 Glycolate C00168 Hydroxypyruvate C00183 L-Valine C00209 Oxalate C00237 CO C00249 Hexadecanoicacid C00331 Indolepyruvate C00487 Carnitine C00506 L-Cysteate C00811 4-Coumarate C00975 Dihydroxyfumarate C01146 2-Hydroxy-3-oxopropanoate C01353 Carbonicacid C01838 Octadecanal C02367 3-Oxododecanoicacid C02657 6-Methylsalicylate C03066 3-Hydroxy-L-glutamate C03277 Imidazol-5-yl-pyruvate C03459 2-Hydroxy-3-oxosuccinate Metabolites in cluster 10: C00024 Acetyl-CoA C00083 Malonyl-CoA C00091 Succinyl-CoA C00332 Acetoacetyl-CoA C00356 S-3-Hydroxy-3-methylglutaryl-CoA C00406 Feruloyl-CoA C00531 Itaconyl-CoA C00566 3S-Citryl-CoA C00683 S-2-Methyl-3-oxopropanoyl-CoA C00904 Citramalyl-CoA C01011 3S-Citramalyl-CoA C01213 R-2-Methyl-3-oxopropanoyl-CoA C02557 Methylmalonyl-CoA C03231 3-Methylglutaconyl-CoA C04316 1-Hydroxycyclohexan-1-ylacetyl-CoA C04348 3S-3-Carboxy-3-hydroxypropanoyl-CoA C06027 L-erythro-3-Methylmalyl-CoA C06028 Mesaconyl-CoA C07303 4-Hydroxy-3-methoxyphenyl-beta-hydroxypropionyl-CoA Metabolites in cluster 11: C05421 15-cis-Phytoene C05432 Lycopene C05433 alpha-Carotene C05435 gamma-Carotene C08586 delta-Carotene C15857 9,9'-Di-cis-zeta-carotene C15858 7,9,7',9'-Tetra-cis-lycopene C15859 1'-Hydroxy-gamma-carotene C15870 Rhodopin C15907 1',2'-Dihydro-gamma-carotene C16276 epsilon-Carotene Metabolites in cluster 12: C00129 Isopentenyldiphosphate C00235 Dimethylallyldiphosphate C00341 Geranyldiphosphate C00353 Geranylgeranyldiphosphate C00448 trans,trans-Farnesyldiphosphate C03190 +-Bornyl-diphosphate C06089 ent-Copalyldiphosphate C06111 Nerolidyldiphosphate C11901 Copalyldiphosphate C11902 syn-Copalyldiphosphate Metabolites in cluster 13: C00687 dTDP-4-dehydro-6-deoxy-alpha-D-glucose C00688 dTDP-4-dehydro-6-deoxy-L-mannose C00842 dTDP-glucose C02097 dTDP-galactose C06617 dTDP-3-oxo-6-deoxy-alpha-D-glucose C11907 4,6-Dideoxy-4-oxo-dTDP-D-glucose C11908 3,6-Dideoxy-3-oxo-dTDP-D-glucose C11926 dTDP-4-oxo-6-deoxy-D-allose C11930 dTDP1-esterwith6R-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran C11931 dTDP1-esterwith6S-5,6-dihydro-4-hydroxy-6-methyl-5-oxo-2H-pyran Metabolites in cluster 14: C00072 Ascorbate C00425 Dehydroascorbate C00800 L-Gulonate C01040 L-Gulono-1,4-lactone C01041 Monodehydroascorbate C01115 L-Galactono-1,4-lactone C03289 L-xylo-Hexulonolactone C04575 4R,5S-4,5,6-Trihydroxy-2,3-dioxohexanoate C05422 L-Dehydroascorbate C15930 L-Galactonate Metabolites in cluster 15: C01226 12-OPDA C04672 9Z,15Z-13S-12,13-Epoxyoctadeca-9,11,15-trienoicacid C04785 13S-HPOT C06427 9Z,12Z,15Z-Octadecatrienoicacid C16319 Etherolenicacid C16320 Colnelenicacid C16321 9S-HPOT C16324 9,10-EOT C16325 10-OPDA