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Ontology Browser

Term:
Parent Terms Term With Siblings Child Terms
(+)-albicanol 
(+)-alpha-pinene 
(+)-alpha-tocopherol +   
(+)-alpha-viniferin  
(+)-aplysinillin 
(+)-catechin +   
(+)-conocarpan  
(+)-dehydrodiconiferyl alcohol 
(+)-dexrazoxane +   
(+)-dihydromyricetin  
(+)-flavipucine 
(+)-gallocatechin +  
(+)-halomon 
(+)-jasplakinolide V 
(+)-jasplakinolide W 
(+)-jasplakinolide Z1 
(+)-jasplakinolide Z2 
(+)-jasplakinolide Z3 
(+)-jasplakinolide Z5 
(+)-lyoniresinol +  
(+)-schisandrin B  
(+)-sesamin +   
(+)-subersic acid 
(+)-syringaresinol +   
(+)-tephrorin A 
(+)-tephrorin B 
(+)-tephrosone 
(-)-(S)-chlorizidine A 
(-)-anisomycin  
(-)-annonaine +  
(-)-antofine  
(-)-beta-elemene 
(-)-coronaridine +  
(-)-cubebin 
(-)-demecolcine  
(-)-duryne 
(-)-duryne B 
(-)-duryne C 
(-)-duryne D 
(-)-duryne E 
(-)-duryne F 
(-)-epicatechin +   
(-)-epigallocatechin +   
(-)-epigallocatechin 3-gallate  
(-)-flavipucine 
(-)-gallocatechin +  
(-)-gallocatechin gallate 
(-)-jasplakinolide Z4 
(-)-larreatricin 
(-)-marinopyrrole A 
(-)-noscapine  
(-)-syringaresinol O,O'-bis(beta-D-glucoside) 
(-)-trans-carveol 
(-)-voacangine 
(1,2-diaminocyclohexane)PtCl2 
(10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester 
(10E,15Z)-9,12,13-trihydroxy-10,15-octadecadienoic acid 
(11Z)-icos-11-enoic acid +  
(11Z,14Z,17Z)-icosatrienoate 
(13E)-octadecenoic acid 
(13R)-13-dihydrocarminomycin 
(13R)-S-cysteinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid 
(13R)-S-cysteinylglycinyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid 
(13R)-S-glutathionyl-(14S)-hydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid 
(13R,14S)-dihydroxy-(4Z,7Z,9E,11E,16Z,19Z)-docosahexaenoic acid 
(13S)-hydroxy-(14S,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid 
(15Z)-tetracosenoate +  
(17Z)-hexacosenoic acid +  
(18R)-resolvin E3 
(18S)-resolvin E1 
(18S)-resolvin E2 
(1R,2R,4S,5S,6R,7S)4,5-epoxygermacra-9Z-en-1,2,6-triol 
(1R,5R,6S,7R,8S,10R)-8-hydroxy-4-oxopseudoguai-2(3),11(13)-dien-12,6-olide 
(1R,5R,6S,7S,8S,10R,11S)-6-hydroxy-4-oxopseudoguai-2(3)-en-12,8-olide 
(1S)-1,23,25-trihydroxy-24-oxocalciol 
(1S)-1,25-dihydroxy-24-oxocalciol 
(1S,2R,5R,6S,7R,8S,10R)-6-acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide 
(1S,2R,5R,6S,7S,8S,10R)-6-hydroxy-2-ethoxy-4-oxopseudoguai-11(13)-en-12,8-olide 
(1S,2R,5R,6S,7S,8S,10R)-6-hydroxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide 
(1S,2S,5R,6S,7R,8S,10R)-6-acetoxy-2-methoxy-4-oxopseudoguai-11(13)-en-12,8-olide 
(1S,5R,6S,7S,8S,10R,11R)-6-hydroxy-4-oxopseudoguai-12,8-olide 
(1S,5S,7R,8S,10R)-14-acetoxy-4-oxopseudoguai-11(13)-en-12,8-olide 
(2,3-diphenylcyclopropyl)methyl phenyl sulfoxide 
(2->6)-beta-D-fructan 
(2-aminoethyl)phosphonic acid +  
(2-hydroxyphenyl)acetate 
(2-hydroxyphenyl)acetic acid 
(2-trans,6-cis)-dodeca-2,6-dienoyl-CoA 
(20R)-17alpha,20-dihydroxycholesterol 
(20R)-ginsenoside Rg3 
(20R,22R)-20,22-dihydroxycholesterol 
(20S)-20-hydroxypregn-4-en-3-one  
(20S)-ginsenoside Rg3 +   
(20S)-ginsenoside Rh2  
(20S)-hydroxyvitamin D3 
(20S,23)-dihydroxyvitamin D3 
(20S,23,24)-trihydroxyvitamin D3 
(20S,23,25)-trihydroxyvitamin D3 
(20S,24R)-dihydroxyvitamin D3 
(20S,24S)-dihydroxyvitamin D3 
(223)RaCl2 
(22E,24R)-5alpha,8alpha-epidioxyergosta-6,9,22-triene-3beta-ol-3-O-beta-D-glucopyranoside 
(23S)-23,25,26-trihydroxycalciol +  
(24E)-3alpha,7alpha-dihydroxy-5beta-cholest-24-en-26-oyl-CoA 
(24R)-24,25-dihydroxycalciol 
(24R,25R)-3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA 
(24S)-24-hydroxycholesterol +   
(24S)-7alpha,24-dihydroxycholesterol 
(24S,25)-dihydroxycholesterol 
(24S,26)-dihydroxycholesterol 
(24Z),26-hydroxydesmosterol 
(25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) 
(25R)-5beta-spirostan-3beta-ol +  
(25R)-7alpha,26-dihydroxycholest-4-en-3-one 
(25R)-cholest-5-ene-3beta,26-diol +   
(25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl-CoA 
(2R,3S)-2-methyl-3-propyloxirane 
(2S),(2''S)-8,8''-5',5''-tetrahydroxy-7,7''-3,3''-4,4''-hexamethoxy-5,5''-biflavan 
(2S),(2''S)-8,8''-5'-trihydroxy-7,7''-3,3''-4,4''-5''-heptamethoxy-5,5''-biflavan 
(2S)-(-)-kurarinone +  
(2S)-1-O-(7Z,10Z)-hexadecadienoyl-2-O-(7Z,10Z)-hexadecadienoyl-3-O-beta-D-galactopyranosyl-sn-glycerol 
(2S)-1-O-(7Z,10Z)-hexadecadienoyl-2-O-linoleoyl-3-O-beta-D-galactopyranosyl-sn-glycerol 
(2S)-1-O-(7Z,10Z,13Z)-hexadecatrienoyl-2-O-(7Z,10Z)-hexadecadienoyl-3-O-beta-D-galactopyranosyl-sn-glycerol 
(2S)-1-O-(9Z,12Z)-octadecadienoyl-2-O-(7Z,10Z)-hexadecadienoyl-3-O-(alpha-D-galactopyranosyl(1->6)-beta-D-galactopyranosyl)-sn-glycerol 
(2S)-2'-hydroxy-7,8,3',4',5'-pentamethoxyflavan 
(2S)-2'-methoxykurarinone 
(2S)-2-(4-\{[(1R,2S)-2-hydroxycyclopentyl]methyl\}phenyl)propanoic acid 
(2S)-5,7-dimethoxy-8-(2S-hydroxy-3-methyl-3-butenyl)-3',4'-methylenedioxyflavanone 
(2S)-5,7-dimethoxy-8-formylflavanone 
(2S)-5-Hydroxy-7-methoxy-8-[(E)-3-oxo-1-butenyl]flavanone 
(2S,3R)-3-hydroxybutane-1,2,3-tricarboxylate 
(2S,3S)-2,3-dihydro-3-hydroxymethyl-2-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran 
(2S,3S)-3-hydroxy-2-methylbutanoyl-CoA(4-) 
(3,4-dihydroxyphenyl)acetate 
(3,4-dihydroxyphenyl)acetic acid +   
(3beta,16alpha)-16-hydroxy-13,28-epoxyoleanan-3-yl alpha-L-Rhap-(1->2)-beta-D-Glcp-(1->4)-[beta-D-Glcp-(1->2)]-alpha-L-arabinopyranoside 
(3E)-2,3,4-trimethylhex-3-enal 
(3E)-2,6-dimethyloct-3-ene 
(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid 
(3S)-3-\{[3',4'-difluoro-5-(\{4'-fluoro-6-[(3S)-pyrrolidinium-3-yloxy][biphenyl]-3-yl\}carbamoyl)[biphenyl]-2-yl]oxy\}pyrrolidinium dichloride 
(3S)-3-hydroxy-3-methylglutaryl-CoA 
(3S)-citramalyl-CoA(5-) 
(3Z,6Z)-dodecadienoyl-CoA 
(4-hydroxy-3-methoxyphenyl)acetaldehyde 
(4-hydroxyphenyl)acetaldehyde 
(4-hydroxyphenyl)pyruvic acid +  
(4betaH)-5alpha-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(10),11(13)-guaiadien-12,6alpha-olide 
(4betaH)-8alpha-(2-methylbut-2-enoyloxy)-2-oxo-1(5),10(14),11(13)-guaiatrien-12,6alpha-olide 
(4E)-7-methyldec-4-ene 
(4Z,7Z,10S,11E,13Z,15E,17S,19Z)-10,17-dihydroxydocosahexaenoic acid 
(4Z,7Z,10Z,12E,14R,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid 
(4Z,7Z,10Z,12E,14S,16Z,19Z)-14,22-dihydroxydocosahexaenoic acid 
(4Z,7Z,10Z,13Z,15E,19Z)-17-oxodocosahexaenoic acid 
(4Z,7Z,10Z,13Z,16Z)-docosa-4,7,10,13,16-pentaenoic acid +   
(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoate +  
(5,6-dimethyl-1,10-phenanthroline)(1S,2S-diaminocyclohexane)platinum(II)(2+) 
(5-hydroxyindol-3-yl)acetaldehyde  
(5-hydroxyindol-3-yl)acetate 
(5-hydroxyindol-3-yl)acetic acid  
(5alpha)-androst-3-en-17-one 
(5Z)-5-(quinoxalin-6-ylmethylidene)-1,3-thiazolidine-2,4-dione 
(5Z)-tetradecenoylcarnitine 
(5Z,11Z,14Z)-icosatrienoic acid 
(5Z,9E,12S,14Z)-8,11,12,20-tetrahydroxyicosa-5,9,14-trienoic acid 
(5Z,9E,12S,14Z)-8,11,12-trihydroxyicosa-5,9,14-trienoate 
(5Z,9E,14Z)-(8xi,11R,12S)-11,12-epoxy-8-hydroxyicosa-5,9,14-trienoate 
(5Z,9Z,12Z)-octadecatrienoic acid +  
(6E,8Z)-5-oxooctadecadienoic acid 
(6R)-5,10-methenyltetrahydrofolate +  
(6R)-5,10-methylenetetrahydrofolate(2-) +  
(6S)-5,6,7,8-tetrahydrofolate(2-) 
(6S)-5-formyltetrahydrofolate(2-) 
(6S)-5-formyltetrahydrofolic acid 
(7R,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid 
(7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoic acid 
(7R,8R)-AGI-B4 
(7Z,10Z,13Z,16Z,19Z)-docosapentaenoate +  
(7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid +  
(9E)-10-nitrooctadecenoic acid 
(9E)-9-nitrooctadecenoic acid 
(9Z,11E,13Z)-octadecatrienoic acid +  
(alpha-D-mannosyl)2-beta-D-mannosyl-diacetylchitobiosyldiphosphodolichol 
(alpha-D-mannosyl)3-beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
(alpha-D-mannosyl)4-beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
(alpha-D-mannosyl)5-beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
(alpha-D-mannosyl)6-beta-D-mannosyl-diacetylchitobiosyldiphosphodolichol 
(alpha-D-mannosyl)7-beta-D-mannosyl-diacetylchitobiosyldiphosphodolichol 
(E)-2,3,5,4'-tetrahydroxystilbene-2-O-beta-D-glucoside 
(E)-4-oxonon-2-enal 
(E)-dec-3-en-2-ol 
(E)-hexadec-2-enoyl-CoA(4-) 
(E)-trans-miyabenol C 
(N(omega)-L-arginino)succinate(1-) 
(R)-2-hydroxy-4-methylpentanoate 
(R)-3-hydroxybutanoyl-CoA(4-) 
(R)-3-hydroxybutyrate +  
(R)-3-hydroxybutyric acid +  
(R)-3-hydroxylauric acid +  
(R)-4'-phosphonatopantothenate(3-) 
(R)-5-diphosphomevalonic acid 
(R)-5-phosphonatomevalonate(3-) 
(R)-adrenaline(1+) 
(R)-amygdalin 
(R)-bicalutamide +   
(R)-homocamptothecin +  
(R)-icosanoylcarnitine 
(R)-lactaldehyde 
(R)-lactic acid +   
(R)-lisofylline +  
(R)-methylmalonyl-CoA(5-) 
(R)-mevalonate 
(R)-noradrenaline(1+) 
(R)-oleoylcarnitine 
(R)-oleoylcarnitine hydrochloride 
(R)-propane-1,2-diol 
(R)-S-lactoylglutathionate(1-) 
(R)-S-lactoylglutathione 
(RS)-mallotophilippen E 
(S)-2,3-epoxysqualene 
(S)-2-hydroxy-3-methylbutyrate 
(S)-2-hydroxy-3-methylbutyric acid 
(S)-3-aminoisobutyric acid 
(S)-3-hydroxybutanoyl-CoA(4-) 
(S)-3-hydroxydecanoyl-CoA 
(S)-3-hydroxyhexanoyl-CoA 
(S)-3-hydroxyisobutyryl-CoA 
(S)-3-hydroxylauroyl-CoA 
(S)-3-hydroxyoctanoyl-CoA 
(S)-3-hydroxypalmitoyl-CoA 
(S)-3-hydroxytetradecanoyl-CoA 
(S)-3-sulfonatolactate(2-) 
(S)-carnitinium 
(S)-dihydroorotate 
(S)-dihydroorotic acid 
(S)-glaucine +   
(S)-lactaldehyde 
(S)-lactic acid +   
(S)-malate(2-) +  
(S)-methylmalonyl-CoA(5-) 
(S)-propane-1,2-diol +  
(Z)-2-penten-1-ol 
(Z)-but-2-ene-1,2,3-tricarboxylate 
1'-acetoxychavicol acetate  
1,1,3,3-tetramethylurea 
1,2,3,4-tetrachlorobutane 
1,2-di-[(6Z)-octadecenoyl]-sn-glycero-3-phosphocholine 
1,2-diacyl-sn-glycero-3-phosphocholine(1+) +   
1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine 
1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion 
1,2-dioleoyl-sn-glycero-3-phospho-N-methylethanolamine 
1,2-dioleoyl-sn-glycero-3-phospho-N-methylethanolamine zwitterion 
1,2-distearoylphosphatidylethanolamine zwitterion +  
1,3,5-trihydroxy-2-(2',2'-dimethyl-4'-isopropenyl)cyclopentanylxanthone 
1,3,6-trihydroxy-2-methyl-9,10-anthraquinone-3-O-(6'-O-acetyl)-alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranoside 
1,3,7,9-tetramethyluric acid 
1,4-butanediammonium 
1,4-dithiothreitol +   
1,5,6-trihydroxy-6',6'-dimethyl-2H-pyrano(2',3':3,4)-2-(3-methylbut-2-enyl)xanthone 
1,5-anhydro-D-glucitol 
1,6,7-trihydroxy-6',6'-dimethyl-2H-pyrano(2',3':3,2)-4-(3-methylbut-2-enyl)xanthone 
1,7-bis-(4-hydroxyphenyl)-2,4,6-heptatrienone 
1-(2-hydroxy-4-methoxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)propane 
1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)hexan-1-one 
1-(3,5-dichloro-2,6-dihydroxy-4-methoxyphenyl)pentan-1-one 
1-(4'-hydroxy-3'-methoxyphenyl)-7-phenyl-3-heptanone 
1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine 
1-[(10Z,13Z,16Z)-docosatrienoyl]-2-[(9Z,12Z)-hexadecadienoyl]-sn-glycero-3-phospho-1D-myo-inositol 
1-[(10Z,13Z,16Z)-docosatrienoyl]-2-hexadecanoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(10Z,13Z,16Z)-docosatrienoyl]-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(13Z,16Z)-docosadienoyl]-2-hexadecanoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(13Z,16Z)-docosadienoyl]-2-linoleoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(1Z,9Z)-octadecadienyl]-sn-glycero-3-phosphocholine 
1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-2-[(11Z)-icosenoyl]-sn-glycero-3-phospho-1D-myo-inositol 
1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-2-[(11Z)-octadecenoyl]-sn-glycero-3-phospho-1D-myo-inositol 
1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-2-icosanoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(8Z,11Z,14Z,17Z)-icosatetraenoyl]-2-octadecanoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-[(9Z)-hexadecenoyl]-sn-glycero-3-phosphocholine 
1-acyl-sn-glycerol 3-phosphate(2-) +  
1-acylglycerone 3-phosphate(2-) +  
1-alkyl-2-acetyl-sn-glycerol +  
1-alkyl-2-acetyl-sn-glycerol 3-phosphate(2-) 
1-alkyl-2-acyl-sn-glycero-3-phosphoethanolamine +  
1-alkyl-2-acyl-sn-glycerol +  
1-alkyl-sn-glycerol 3-phosphate(2-) +  
1-alkylglycerone 3-phosphate +  
1-alkylglycerone 3-phosphate(2-) +  
1-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-arachidonoyl-sn-glycero-3-phosphoethanolamine 
1-behenoylglycerol 
1-bromo-2-propanol 
1-chlorobutan-2-ol 
1-deoxysphinganine +  
1-docosene 
1-ethyl-2-propylcyclohexane 
1-feruloyl-sn-glycerol 
1-hexadecanoyl-2-(9-oxononanoyl)-sn-glycero-3-phosphocholine 
1-hexadecanoyl-sn-glycero-3-phospho-D-myo-inositol 
1-hexadecanoyl-sn-glycero-3-phosphoethanolamine 
1-icosapentaenoyl-sn-glycero-3-phosphocholine 
1-iodo-2-methylundecane 
1-isothiocyanato-6-(methylsulfanyl)hexane 
1-linoleoyl-sn-glycero-3-phosphoethanolamine 
1-linoleoyl-sn-glycero-3-phosphoethanolamine zwitterion 
1-methyladenosine 
1-methylimidazole-4-acetaldehyde 
1-methylnicotinamide +   
1-methylpyrrolinium 
1-methyltryptophan  
1-O-(alpha-D-galactosyl)-N-hexacosanoylphytosphingosine +   
1-O-3,4-dimethoxy-5-hydroxyphenyl-(6-O-3,5-dimethoxygalloyl)-beta-D-glucopyranoside 
1-O-3,4-dimethoxy-5-hydroxyphenyl-(6-O-vanilloyl)-beta-D-glucopyranoside 
1-O-all-trans-retinoyl-beta-glucuronic acid 
1-O-caffeoylquinic acid 
1-O-feruloyl-beta-D-glucose 
1-octadec-9-enoylglycero-3-phosphate  
1-octadecylglycero-3-phosphocholine 
1-oleoyl-2-arachidonoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-oleoyl-sn-glycero-3-phosphoethanolamine 
1-pentadecanoyl-2-[(5Z,8Z,11Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholine 
1-pentadecyl-2-acetyl-sn-glycero-3-phosphocholine 
1-phenylethylamine +  
1-phosphatidyl-1D-myo-inositol 3,4,5-trisphosphate(7-) +  
1-phosphatidyl-1D-myo-inositol 3,4-bisphosphate(5-) +  
1-phosphatidyl-1D-myo-inositol 3,5-bisphosphate(5-) +  
1-phosphatidyl-1D-myo-inositol 3-phosphate(3-) +  
1-phosphatidyl-1D-myo-inositol 4,5-bisphosphate +  
1-phosphatidyl-1D-myo-inositol 4-phosphate(3-) +  
1-phosphatidyl-1D-myo-inositol 5-phosphate(3-) +  
1-phosphatidyl-1D-myo-inositol(1-) +  
1-piperideine-2-carboxylate 
1-piperideine-6-carboxylate +  
1-pyrroline-2-carboxylate 
1-pyrroline-5-carboxylate +  
1-pyrrolinium +  
1-stearoyl-2-arachidonoyl-sn-glycero-3-phosphoethanolamine 
1-stearoyl-sn-glycero-3-phospho-1D-myo-inositol 
1-stearoyl-sn-glycero-3-phosphoethanolamine 
10-formyltetrahydrofolate(2-) 
10-hydroxycanthin-6-one 
10-nonadecenoate 
10-nonadecenoic acid +  
10-PAHSA 
10-PAHSA(1-) 
10058-F4 
11(R)-HEPE 
11(R)-HEPE(1-) 
11,20-dihydroxysugiol 
11-cis-retinal +  
11-cis-retinoic acid 
11-cis-retinol +  
11-cis-retinyl palmitate 
11-dehydro-thromboxane B2  
11-dehydrocorticosterone  
11-deoxycorticosterone +   
11-deoxycortisol  
11-epi-prostaglandin F2alpha +  
11-epi-prostaglandin F2alpha(1-) 
11-nitro-1-undecene 
11-oxo-ETE +  
11-oxotestosterone 
11-PAHSA 
11-PAHSA(1-) 
11beta-hydroxyandrost-4-ene-3,17-dione 
11beta-hydroxyprogesterone 
12(S)-HETE 
12(S)-HPETE(1-) 
12-deacetoxy-21-acetoxyscalarin 
12-HETE +  
12-hydroxylauric acid +   
12-O-acetyl-16-O-deacetyl-16-epi-scalarobutenolide 
12-PAHSA 
12-PAHSA(1-) 
12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid +  
13(S)-HODE 
13(S)-HPODE +  
13(S)-HPODE(1-) 
13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid 
13,14-dihydro-15-oxolipoxin A4 
13,14-dihydro-15-oxolipoxin A4(1-) 
13,14-dihydro-Delta(12)-prostaglandin J2  
13,14-dihydrolipoxin A4 
13,14-dihydrolipoxin A4(1-) 
13-cis-retinal  
13-cis-retinol +  
13-deoxycarminomycin 
13-hydroxy-(14R,15S)-epoxy-(5Z,8Z,11Z)-icosatrienoic acid 
13-hydroxy-alpha-tocopherol 
13-PAHSA 
13-PAHSA(1-) 
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid 
14-demethyllanosterol +   
14-norpseurotin A 
15(R)-HEPE 
15(R)-HEPE(1-) 
15(S)-HETE 
15(S)-HPETE(1-) 
15-dehydro-prostaglandin E1(1-) 
15-dehydroprostaglandin A1 
15-ketoprostaglandin F1alpha(1-) 
15-O-deacetylnimbolidin B 
15-oxo-ETE +   
16(S)-HETE 
16,23,29-trihydroxy-3-oxo-olean-12-en-28-oic acid 
16,23-epoxy-5beta-cholestane triglycoside 
16-O-deacetyl-16-epi-scalarolbutenolide 
16alpha-hydroxydehydroepiandrosterone 
16alpha-hydroxyestrone +  
16alpha-hydroxypregnenolone 
16beta-[(alpha-L-arabinopyranosyl)oxy]-3beta-[(beta-D-glucopyranosyl)oxy]-17alpha-hydroxycholest-5-en-22-one 
16beta-[(O-(2-O-(E)-cinnamoyl-beta-D-xylopyranosyl)-(1->2)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]-3beta-[(beta-D-glucopyranosyl)oxy]-17alpha-hydroxycholest-5-en-22-one 
17-defurano-17-oxosalannin 
17-epi-17-hydroxyazadiradione 
17-phenyl-18,19,20-trinor-prostaglandin D2 
17-phenyl-18,19,20-trinor-prostaglandin E2 
17alpha-ethynylestradiol 3-sulfate 
17alpha-hydroxypregnenolone +   
17alpha-hydroxyprogesterone  
17alpha-hydroxywithanolide D 
17beta-estradiol +   
17beta-estradiol 3-glucosiduronic acid  
17beta-hydroxy-5alpha-androstan-3-one +   
17beta-hydroxy-5beta-estran-3-one 
18(R)-HEPE 
18(R)-HEPE(1-) 
18(S)-HEPE 
18-hydroxycorticosterone 
18-oxotryprostatin A 
19alpha-hydroxyasiatic acid +  
1alpha,23(S),25-trihydroxyvitamin D3 
1alpha,2beta,25-trihydroxy vitamin D3 
1D-myo-inositol 1,3,4,5-tetrakisphosphate(8-) 
1D-myo-inositol 1,3,4-trisphosphate(6-) 
1D-myo-inositol 1,4,5,6-tetrakisphosphate(8-) 
1D-myo-inositol 1,4,5-trisphosphate(6-) 
1D-myo-inositol 1,4-bisphosphate(4-) 
1D-myo-inositol 1-phosphate  
1D-myo-inositol 1-phosphate(2-) 
1D-myo-inositol 3,4,5,6-tetrakisphosphate(8-) 
1D-myo-inositol 3,4-bisphosphate 
1D-myo-inositol 3-phosphate(2-) 
1D-myo-inositol 4-phosphate(2-) 
1R,4S,6R-1,4-endoperoxy-bisabola-2,10-diene 
1S,4R,6R-1,4-endoperoxy-bisabola-2,10-diene 
1S,6R-di(2-)methylbutanoyloxy-4S-hydroxy-8S-benzoyloxy-9R-(3-)furancarbonyloxy-13-acetyloxy-beta-dihydroagarofuran 
2',3'-cyclic UMP(1-) 
2',4'-dihydroxy-3'-(2-hydroxy benzyl)-6'-methoxy chalcone 
2',4,4',6'-tetrahydroxychalcone +   
2',4,4',6'-tetrahydroxychalcone(1-) 
2'-deoxyadenosine +   
2'-deoxyadenosine 5'-monophosphate(2-) +  
2'-deoxycytidine +   
2'-deoxycytosine 5'-monophosphate(2-) +  
2'-deoxyguanosine +   
2'-deoxyguanosine 5'-monophosphate(2-) +  
2'-deoxyinosine 
2'-deoxyinosine 5'-phosphate(2-) 
2'-deoxyinosine-5'-diphosphate 
2'-deoxyinosine-5'-monophosphate 
2'-deoxyuridine +  
2'-hydroxychalcone  
2'-hydroxydaidzein 
2'-hydroxydaidzein(1-) 
2'-hydroxyformononetin 
2'-phospho-cyclic ADP-ribose 
2,3,3-trimethylpentane 
2,3,5,8-tetramethyldecane 
2,3,5-trimethylhexane 
2,3-bisphosphoglyceric acid +   
2,3-bisphosphonato-D-glycerate(5-) 
2,3-dihydro-3beta-O-sulfate withaferin A 
2,3-dihydroxybutanoic acid +  
2,3-diketogulonate 
2,3-epoxymenatetrenone 
2,4,4',6-tetrahydroxydibenzoylmethane 
2,4,4-trimethylpentane-1,3-diyl bis(2-methylpropanoate) 
2,4-di-tert-butylphenol  
2,4-dihydroxy-6-methylbenzaldehyde 
2,4-dimethyl-1-heptene 
2,4-dimethylhexane 
2,4-dimethylpentan-3-amine 
2,5,6-triamino-4-hydroxypyrimidine 
2,5-bis(2-hydroxyethylamino)-3,6-diaziridinylbenzoquinone 
2,5-diamino-6-ribosylamino-4(3H)pyrimidinone 5'-triphosphate 
2,5-dihydroxybenzaldehyde  
2,5-dihydroxybenzoate 
2,5-dihydroxybenzoic acid +   
2,5-epoxy-2beta-hydroxy-8alpha-(2-methylbut-2-enoyloxy)-4(15),10(14),11(13)-germacratrien-12,6alpha-olide 
2,6,10,14-tetramethylheptadecane 
2,6,10,15-tetramethylheptadecane 
2,6-di-tert-butyl-4-methylphenol  
2,6-di-tert-butylphenol  
2,7,10-trimethyldodecane 
2-(2,4-dihydroxy-5-prenylphenyl)-5,6-methylenedioxybenzofuran 
2-(2,4-dihydroxyphenyl)-5-(E)-propenylbenzofuran 
2-(2-carboxyethyl)-4-methyl-5-propylfuran-3-carboxylic acid 
2-(2-hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran 
2-(3,4-dihydroxyphenyl)-ethyl-O-beta-D-glucopyranoside 
2-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran 
2-(4-hydroxyphenyl)ethanol +   
2-(4-methoxyphenyl)propan-2-ol 
2-(4-methyl-1-piperazinyl)ethanamine 
2-(6-methoxy-1-oxo-1,3-dihydro-2H-isoindol-2-yl)-N-[4-(piperazin-1-yl)pyridin-3-yl]-1,3-thiazole-4-carboxamide 
2-(7-aminoheptyl)guanidine 
2-(beta-D-glucopyranosyloxy)benzoic acid 
2-acetamido-2-deoxy-D-glucopyranose 1-phosphate +  
2-acetamido-5-oxopentanoate 
2-acetamidophenol  
2-amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid +  
2-amino-3-oxoadipic acid 
2-amino-3-phosphonopropanoic acid 
2-amino-5-[(1-methoxy-2-methylindolizin-3-yl)carbonyl]benzoic acid 
2-aminoacrylic acid +  
2-aminoethanesulfonate 
2-aminomuconate 6-semialdehyde(1-) 
2-aminomuconate(2-) 
2-aminooctanoic acid 
2-aminooctanoic acid zwitterion 
2-ammonio-2-deoxy-D-glucopyranose +  
2-ammonio-2-deoxy-D-glucopyranose 6-phosphate(1-) +  
2-ammoniomuconate(1-) 
2-arachidonoylglycerol +   
2-butyl-1-octanol +  
2-cis,6-trans,10-trans-geranylgeranyl diphosphate 
2-decaprenyl-6-methoxy-1,4-benzoquinone 
2-decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone 
2-decaprenyl-6-methoxyphenol 
2-dehydro-L-gluconic acid 
2-deoxy-D-ribofuranose 
2-deoxy-D-ribofuranose 1-phosphate(2-) 
2-deoxy-D-ribonate 
2-deoxy-D-ribonic acid 
2-deoxy-D-ribose +  
2-deoxy-D-ribose 5-phosphate(2-) 
2-ethylhydracrylate 
2-ethylhydracrylic acid 
2-fluoroadenine +  
2-formamido-N(1)-(5-O-phosphonato-D-ribosyl)acetamidine +  
2-heptyl-3-hydroxy-4-quinolone 
2-heptyl-4-hydroxyquinoline 
2-heptyl-4-quinolone 
2-hydroxy-17beta-estradiol +   
2-hydroxy-3-methylbutyrate 
2-hydroxy-3-methylbutyric acid +  
2-hydroxyacrylic acid 
2-hydroxybutyrate +  
2-hydroxybutyric acid +  
2-hydroxyestrone +   
2-hydroxyglutaramic acid 
2-hydroxyhexadecanoate +  
2-hydroxyhexadecanoic acid +  
2-hydroxylinoleic acid 
2-hydroxymelatonin 
2-hydroxyoctadecanoate +  
2-hydroxyoctadecanoic acid +  
2-hydroxyoleic acid 
2-hydroxyphytanoyl-CoA(4-) 
2-isopropyl-5-methyl-1-heptanol 
2-isopropylaminoethylamine 
2-linoleoyl-sn-glycero-3-phosphoethanolamine 
2-methoxy-17beta-estradiol +   
2-methoxyestrone +   
2-methyl-1,3-thiazolidine-2-carboxamide 
2-methyl-1-pentene 
2-methyl-3-ketovaleric acid 
2-methyl-3-oxopropanoate +  
2-methyl-3-sulfanylbutan-1-ol 
2-methylacetoacetyl-CoA(4-) 
2-methylbutan-2-amine 
2-methylbutanoyl-CoA(4-) +  
2-methylbutyric acid +   
2-methylbutyrylcarnitine +  
2-methylcitrate(3-) +  
2-methylcrotonoyl-CoA(4-) 
2-methylerythritol 
2-methylhexenoyl-CoA 
2-methyltridecane 
2-oxoadipate(2-) 
2-oxoadipic acid  
2-oxobutanoate 
2-oxoglutaramate +  
2-oxoglutarate(2-) 
2-oxopentanoic acid 
2-phenylethanaminium 
2-phenylethylamine +   
2-phospho-D-glyceric acid 
2-phosphonato-D-glycerate(3-) 
2-phosphonatoglycolate(3-) 
2-stearoyl-sn-glycero-3-phosphocholine 
2-tetradecanoyl-sn-glycero-3-phosphocholine 
2-trans,6-trans,10-trans-geranylgeranyl diphosphate(3-) 
2-trans,6-trans-farnesyl diphosphate(3-) 
20(R),22(xi),24(S)-dammar-25(26)-ene-3beta,6alpha,12beta,20,22,24-hexanol 
20(S),25-dihydroxyvitamin D3 
20-epi-bryonolic acid 
20-HETE +   
20-hydroxy-leukotriene B4 
20-hydroxy-leukotriene B4(1-) 
20-hydroxy-leukotriene E4(1-) 
20-hydroxycholesterol  
20-hydroxytubocapsanolide A 
22-hydroxyprotectin D1 
23(S),25-dihydroxy-24-oxovitamin D3 
23,24-dimethylcholest-16(17)-E-en-3beta,5alpha,6beta,20(S)-tetrol 
23-hydroxytubocapsanolide A 
24,25-dihydrolanosterol +   
25-hydroxycholesterol  
25-O-methoxycimigenol 3-O-alpha-L-arabinopyranoside 
26-hydroxycholesterol +   
28-deoxonimbolide  
2alpha,3alpha,23-trihydroxyolean-12-en-28-oic acid 
2alpha,3beta-dihydroxyolean-13(18)-en-28-oic acid 
2alpha-(2'-pyrrolyl)-4alpha-methoxycarbonyl-5beta-[(2''-methyl)-heptyl]-1,3-oxazacyclohexane 
2alpha-(3-hydroxypropyl)-1alpha,25-dihydroxy-19-norvitamin D3 
2alpha-acetoxy-4alpha,6alpha-dihydroxy-1beta,5alphaH-guai-9(10),11(13)-dien-12,8alpha-olide 
2beta-hydroxytestosterone 
2beta-methoxy-2-deethoxy-8-O-deacylphantomolin-8-O-tiglinate 
2beta-methoxy-2-deethoxyphantomolin 
3',4',5-trihydroxy-3,6,7-trimethoxyflavone 
3',4',7-trihydroxyisoflavone  
3',4'-difluoro-N-\{4'-fluoro-6-[(3S)-pyrrolidin-3-yloxy][biphenyl]-3-yl\}-6-[(3S)-pyrrolidin-3-yloxy][biphenyl]-3-carboxamide 
3',5'-cyclic AMP +   
3',5'-cyclic AMP(1-) 
3',5'-cyclic CMP 
3',5'-cyclic dTMP 
3',5'-cyclic GMP +   
3',5'-cyclic GMP(1-) +  
3',5'-cyclic UMP 
3'-(3-methyl-2-butenyl)-4'-O-beta-D-glucopyranosyl-4,2'-dihydroxychalcone 
3'-AMP 
3'-AMP(2-) 
3'-deamino-3'-(3-cyanomorpholin-4-yl)doxorubicin  
3'-dephospho-CoA 
3'-dephospho-CoA(2-) 
3'-O-methyltricetin +  
3'-phosphonato-5'-adenylyl sulfate(4-) 
3'-UMP(2-) 
3,17-dioxoandrost-4-en-19-al 
3,3',5'-triiodothyronine +   
3,3',5,5'-tetraiodothyroacetic acid  
3,3',5-triiodo-L-thyronine +   
3,3',5-triiodo-L-thyronine sulfate 
3,3',5-triiodo-L-thyronine zwitterion 
3,3'-diindolylmethane  
3,3'-diiodo-L-thyronine +  
3,3'-dimethylquercetin 
3,4'-dimethylkaempferol 
3,4-dihydroxy-5-prenylcinnamic acid 
3,4-dihydroxybenzoic acid +   
3,4-dihydroxybutyric acid 
3,4-dihydroxymandelate 
3,4-dihydroxymandelic acid  
3,4-dihydroxyphenylacetaldehyde  
3,5-di-O-caffeoyl quinic acid +  
3,5-dihydroxy-2-(1'-oxo-3'-hexadecenyl)-2-cyclohexene-1-one 
3,5-diiodo-L-tyrosinate(1-) 
3,5-diiodo-L-tyrosine +  
3,5-dimethoxy-4-hydroxybenzyl alcohol-4-O-beta-D-glucopyranoside 
3,5-dimethyloctane 
3,5-dioxooctanedioic acid 
3,7,11-trimethyldodecan-1-ol 
3,7-dihydroxytropolone 
3,7-dimethyl-3-octanol 
3,8-dimethylundecane 
3-(1H-indol-3-yl)propanoate 
3-(1H-indol-3-yl)propanoic acid  
3-(3,4-dihydroxyphenyl)propanoic acid +   
3-(4-deoxy-beta-D-gluc-4-enosyluronic acid)-N-acetyl-D-glucosamine 
3-(4-hydroxyphenyl)lactate +  
3-(4-hydroxyphenyl)lactic acid +  
3-(4-hydroxyphenyl)pyruvate 
3-(imidazol-5-yl)lactic acid +  
3-(indol-3-yl)lactate 
3-(indol-3-yl)lactic acid  
3-(methylthio)propionate 
3-[3-(tert-butylsulfanyl)-1-(4-chlorobenzyl)-5-(propan-2-yl)-1H-indol-2-yl]-2,2-dimethylpropanoic acid  
3-acetamino-6-isobutyl-2,5-dioxopiperazine 
3-aminopiperidine-2-one 
3-beta-O-(E)-coumaroyl-D:C-friedooleana-7,9(11)-dien-29-oic acid 
3-bromopyruvic acid  
3-carboxy-1-hydroxypropylthiamine diphosphate 
3-carboxy-4-methyl-5-propyl-2-furanpropanoate 
3-chloro-L-tyrosine 
3-cyano-L-alanine +  
3-deacetylsalannin 
3-decaprenyl-4,5-dihydroxybenzoic acid +  
3-decaprenyl-4-hydroxy-5-methoxybenzoic acid 
3-dehydro-4-methylzymosterol +  
3-dehydro-L-gulonate 
3-dehydrocarnitine +   
3-dehydrocarnitinium 
3-dehydrosphinganinium(1+) 
3-demethylubiquinone-10 
3-deoxy-D-arabino-hexonic acid 
3-deoxychenodeoxycholic acid 
3-disulfanyl-L-alanine +  
3-epi-heliangin 
3-fucosyllactose 
3-furoic acid +  
3-hydroxy-2-hydroxymethyl-9,10-anthraquinone 
3-hydroxy-2-methylpropanoyl-CoA(4-) 
3-hydroxy-3-methylglutarate(1-) 
3-hydroxy-3-methylglutarate(2-) 
3-hydroxy-3-methylglutaric acid +  
3-hydroxy-3-methylhexanoic acid +  
3-hydroxy-N(6),N(6),N(6)-trimethyl-L-lysine 
3-hydroxyanthranilate 
3-hydroxyanthranilic acid 
3-hydroxybutyrate +  
3-hydroxybutyric acid +   
3-hydroxydocosanoyl-CoA +  
3-hydroxyicosanoyl-CoA +  
3-hydroxyisobutyrate +  
3-hydroxyisovalerate 
3-hydroxyisovaleric acid +   
3-hydroxyisovalerylcarnitine 
3-hydroxykynurenine +   
3-hydroxymandelic acid 
3-hydroxyoctadecanoyl-CoA +  
3-hydroxypropanoyl-CoA(4-) 
3-hydroxypropionate 
3-hydroxypropionic acid +   
3-hydroxypyruvate 
3-hydroxypyruvic acid  
3-hydroxytetracosanoyl-CoA 
3-hydroxytetradecanoic acid +  
3-iodo-L-tyrosine +  
3-keto-beta-D-galactose 
3-mercaptopentanol 
3-mercaptopyruvate 
3-mercaptopyruvic acid 
3-methoxy-3-methylhexane 
3-methyl-2-oxobutanoate 
3-methyl-2-oxobutanoic acid  
3-methyl-2-oxovalerate +  
3-methyl-2-oxovaleric acid +   
3-methyl-3-sulfanylhexan-1-ol 
3-methyladenine  
3-methylbut-2-enoyl-CoA(4-) 
3-methylguanine +  
3-methylhexane 
3-methylhistidine 
3-methylhistidine zwitterion 
3-methylmalate(2-) 
3-methylmalic acid +  
3-O-[2,3-di-O-acetyl-alpha-L-arabinopyranosyl]-hederagenin 28-O-alpha-L-rhamnopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside 
3-O-[3,4-di-O-acetyl-alpha-L-arabinopyranosyl]hederagenin 28-O-alpha-L-rhamnopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside 
3-O-beta-D-galactopyranosyl-sn-glycerol 
3-O-feruloylcycloartenol 
3-O-methyldopa 
3-O-methyldopa zwitterion 
3-oxoadipic acid +  
3-oxochola-4,6-dien-24-oic acid 
3-oxodecanoyl-CoA 
3-oxodocosanoyl-CoA 
3-oxodotriacontanoyl-CoA 
3-oxohexacosanoyl-CoA 
3-oxohexanoyl-CoA 
3-oxoicosanoyl-CoA 
3-oxolauroyl-CoA 
3-oxooctadecanoyl-CoA 
3-oxooctanoyl-CoA 
3-oxopalmitoyl-CoA(4-) 
3-oxopristanoyl-CoA(4-) 
3-oxopropanoate 
3-oxotetracosanoyl-CoA 
3-oxotetradecanoyl-CoA 
3-phenyllactic acid +  
3-phenylpropionate 
3-phenylpropionic acid +   
3-phosphonato-D-glycerate(3-) 
3-phosphonato-D-glyceroyl phosphate(4-) 
3-phosphonatooxypyruvate(3-) 
3-sulfino-L-alanine +  
3-sulfino-L-alanine(1-) +  
3-sulfinylpyruvic acid 
3-sulfonatopyruvate(2-) 
3-tert-butyl-4-hydroxyanisole +   
3-ureidoisobutyric acid 
3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA +  
3alpha,7alpha,12alpha-trihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA(4-) 
3alpha,7alpha,12alpha-trihydroxy-5beta-cholest-24-en-26-oyl-CoA +  
3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-al +  
3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid +  
3alpha,7alpha,12beta-trihydroxy-5beta-cholanate 
3alpha,7alpha,12beta-trihydroxy-5beta-cholanic acid 
3alpha,7alpha,24-trihydroxy-5beta-cholestan-26-oyl-CoA 
3alpha,7alpha-dihydroxy-24-oxo-5beta-cholestan-26-oyl-CoA 
3alpha,7alpha-dihydroxy-5beta-cholest-24-enoyl-CoA 
3alpha,7alpha-dihydroxy-5beta-cholestan-26-al 
3alpha,7alpha-dihydroxy-5beta-cholestan-26-oic acid +  
3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA +  
3alpha-hydroxy-5beta-androstan-17-one +   
3alpha-hydroxy-5beta-androstan-17-one 3-glucosiduronic acid 
3alpha-hydroxy-5beta-pregnan-20-one  
3beta,12-dihydroxy-13-methyl-5,8,11,13-podocarpatetraene-7-one 
3beta,12-dihydroxy-13-methyl-6,8,11,13-podocarpatetraene 
3beta,12alpha-dihydroxy-5beta-cholan-24-oic acid 
3beta,6beta,23-trihydroxyolean-12-en-28-oic acid 
3beta,6beta,23-trihydroxyolean-12-en-28-oic acid 28-O-beta-D-glucopyranoside 
3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid 
3beta,7alpha-dihydroxy-5beta-cholan-24-oic acid 
3beta-[(beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4,5-trimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4-dimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyloxy]cholest-5-en-22-one 
3beta-[(O-beta-D-glucopyranosyl-(1->3)-4,6-dideoxy-2-O-methyl-beta-D-gulopyranosyl)]-5beta,14beta-dihydroxy-19-oxocard-20(22)enolide 
3beta-[(O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4,5-trimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4-dimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-17alphahydroxy-16beta-[(O-(3-O-3,4-dimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4,5-trimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-[(O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyl)oxy]-17alpha-hydroxy-16beta-[(O-(2-O-3,4-dimethoxybenzoyl-beta-D-xylopyranosyl)-(1->3)-2-O-acetyl-alpha-L-arabinopyranosyl)oxy]cholest-5-en-22-one 
3beta-hydroxy-4beta-methyl-5alpha-cholest-8-ene-4alpha-carboxylate 
3beta-hydroxy-4beta-methyl-5alpha-cholest-8-ene-4alpha-carboxylic acid 
3beta-hydroxy-5alpha-cholest-8-ene-4alpha-carboxylate 
3beta-hydroxy-5alpha-cholest-8-ene-4alpha-carboxylic acid 
3beta-hydroxy-5beta-pregnan-20-one +  
3beta-hydroxylanost-8-en-32-al  
3beta-O-\{alpha-L-Rhap-(1->2)-beta-D-Glcp-(1->4)-[beta-D-Glcp-(1->2)]-alpha-L-Arap\}primulagenin A 
3PO 
4''-dehydro-3-hydroxyterphenyllin 
4',5'-dihydro-11,5'-dihydroxy-4'-methoxytephrosin 
4',5,7-trihydroxy-3'-methoxyflavone +   
4',6,7-trihydroxyisoflavone 
4'-demethyldeoxypodophyllotoxin 
4'-demethylepipodophyllotoxin +   
4'-epidoxorubicin  
4'-hydroxychalcone  
4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol  
4,6,8-trimethyl-1-nonene 
4,6-dimethyldodecane 
4,6-dimethylundecane 
4,6-dioxoheptanoic acid  
4,8,12-trimethyltridecanoyl-CoA(4-) 
4-(2,6-dichlorobenzamido)-N-(piperidin-4-yl)-pyrazole-3-carboxamide 
4-(2-aminophenyl)-2,4-dioxobutanoate 
4-(dimethylamino)-N-[7-(hydroxyamino)-7-oxoheptyl]benzamide 
4-(trimethylammonio)butanoate  
4-(trimethylammonio)butanoic acid +  
4-\{[(5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalen-2-yl)carbonyl]amino\}benzoic acid  
4-acetamidobutanal 
4-acetamidobutanoate 
4-ammoniobutanal 
4-coumaroyl-CoA(4-) +  
4-epiisoinuviscolide 
4-ethylphenyl sulfate 
4-ethylphenyl sulfate(1-) 
4-fumarylacetoacetate(2-) 
4-hydroperoxycyclophosphamide  
4-hydroxy-2-oxoglutarate(2-) +  
4-hydroxy-L-prolinate 
4-hydroxy-L-proline zwitterion 
4-hydroxycordoin 
4-hydroxynon-2-enal +   
4-hydroxyphenyl retinamide  
4-hydroxyphenylacetate 
4-hydroxyphenylacetic acid +   
4-hydroxyproline +  
4-iodo-6-phenylpyrimidine 
4-maleylacetoacetate 
4-methoxy-17beta-estradiol +   
4-methoxyestrone +  
4-methoxymagnaldehyde B 
4-methyl-2-oxopentanoate 
4-methyl-2-oxopentanoic acid  
4-methyl-5-pentylbenzene-1,3-diol 
4-methylaeruginoic acid 
4-methylcatechol +   
4-methylpentanal  
4-methylthio-2-oxobutanoate +  
4-methylumbelliferone +   
4-methylumbelliferone beta-D-glucuronide  
4-methylundecane 
4-nitrophenyl hydrogen sulfate  
4-oxobutanoate 
4-phenylbutyric acid  
4-pyridoxate 
4-pyridoxic acid +   
4-terpineol +   
4-trimethylammoniobutanal 
4a-hydroxytetrahydrobiopterin +  
4alpha-formyl-4beta-methyl-5alpha-8-cholesten-3beta-ol 
4alpha-formyl-5alpha-cholest-8-en-3beta-ol 
4alpha-hydroxymethyl-4beta-methyl-5alpha-8-cholesten-3beta-ol 
4alpha-hydroxymethyl-4beta-methylzymosterol 
4alpha-hydroxymethyl-5alpha-cholest-8-en-3beta-ol 
4alpha-methyl-5alpha-cholest-8-en-3-one 
4alpha-methyl-5alpha-cholest-8-en-3beta-ol 
4alpha-methylzymosterol +  
4beta,10alpha-dihydroxy-5alphaH-guai-1(2),11(13)-dien-12,8alpha-olide 
4beta-hydroxycholesterol  
4beta-methylzymosterol-4-carbaldehyde 
5'-acetylphosphoadenosine 
5'-adenylyl sulfate(2-) 
5'-deoxyadenosine 
5'-S-methyl-5'-thioadenosine  
5'-xanthylate(2-) 
5(S),6(S)-epoxy-18(S)-hydroxy-(7E,9E,11Z,14Z,16E)-icosapentaenoic acid 
5(S)-HETE 
5(S)-HPETE(1-) 
5,6,7,8-tetrahydrobiopterin +   
5,6-dihydrothymine 
5,6-dihydrouracil 
5,6-dihydroxyindole-2-carboxylate 
5,6-dimethylbenzimidazole 
5,6-epoxyretinoic acid +  
5,6-trans-vitamin D3 
5,7,3'-trihydroxy-4'-methoxy-8,2'-di(3-methyl-2-butenyl)-(2S)-flavanone 
5-(2,2-diferuloylethen-1-yl)thalidomide 
5-(2-carboxylatoethyl)-4-oxo-4,5-dihydro-1H-imidazol-5-ide 
5-(2-hydroxyethyl)-4-methylthiazole 
5-(3-hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran 
5-(hydroxymethyl)cytosine +   
5-(methylsulfanyl)-2,3-dioxopentyl phosphate(2-) 
5-(N,N-hexamethylene)amiloride  
5-(tetradecyloxy)-2-furoic acid  
5-[2-(feruloyl)ethen-1-yl]thalidomide 
5-amino-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-) +  
5-amino-1-(5-phosphonato-D-ribosyl)imidazol-3-ium 
5-amino-1-(5-phosphonato-D-ribosyl)imidazole-4-carboxylate 
5-amino-2-oxopentanoic acid 
5-aminolevulinic acid +   
5-aminolevulinic acid hydrochloride 
5-aminopentanoic acid +  
5-azacytidine  
5-bromo-2'-deoxyuridine  
5-bromo-8-methoxy-1-methyl-beta-carboline 
5-chloro-7-iodoquinolin-8-ol  
5-diphospho-1D-myo-inositol pentakisphosphate 
5-dodecenoate 
5-dodecenoic acid +  
5-fluorouracil  
5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-) 
5-formimidoyltetrahydrofolate(2-) 
5-formyluracil 
5-guanidino-2-oxopentanoic acid 
5-heptadecylresorcinol 
5-hydroperoxy-15-HETE +  
5-hydroxy-2-(1'-hydroxyethyl)naphtho[2,3-b]furan-4,9-dione 
5-hydroxy-2-methylchromone-7-O-rutinoside 
5-hydroxy-6-methoxy-2-methylchromone-7-O-rutinoside 
5-hydroxy-7-prop-2-en-(E)-ylidene-7,7a-dihydro- 2H-cyclopenta[b]pyran-6-one 
5-hydroxy-7-prop-2-en-(Z)-ylidene-7,7a-dihydro- 2H-cyclopenta[b]pyran-6-one 
5-hydroxy-L-tryptophan 
5-hydroxy-N-formylkynurenine +  
5-hydroxybenzimidazole 
5-hydroxyimidazole-4-carboxamide 
5-hydroxyindole  
5-hydroxyisouric acid +  
5-hydroxykynurenine +  
5-hydroxymethyluracil +  
5-hydroxytryptophan +   
5-methylcytosine +   
5-methyldec-1-ene 
5-methyltetrahydrofolate(2-) 
5-O-demethylpaxanthonin +  
5-O-ethyl embelin 
5-O-methyl embelin 
5-O-phosphonato-alpha-D-ribofuranosyl diphosphate(5-) 
5-O-phosphono-alpha-D-ribofuranosyl diphosphate 
5-oxo-ETE  
5-oxoprolinate +  
5-oxoproline +   
5-PAHSA 
5-PAHSA(1-) 
5-phospho-beta-D-ribosylaminium(1-) 
5alpha,8alpha-epidioxycholest-6-en-3beta-ol 
5alpha,8alpha-epidioxysterol 
5alpha-androstane +   
5alpha-androstane-3alpha,17beta-diol +  
5alpha-androstane-3beta,17beta-diol +  
5alpha-cholest-7-en-3beta-ol +   
5alpha-cholest-8-en-3beta-ol 
5alpha-cholesta-7,24-dien-3beta-ol 
5alpha-pregnane-3,20-dione  
5beta-cholestan-3-one 
5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol +  
5beta-cholestane-3alpha,7alpha,12alpha-triol 
5beta-cholestane-3alpha,7alpha,26-triol 
5beta-cholestane-3alpha,7alpha-diol 
5beta-dihydrotestosterone 
5beta-pregnane-3,20-dione 
5E-7-oxozeaenol 
5Z-7-oxozeaenol 
6'',7''-dihydro-5',5'''-dicapsaicin 
6'-coumaroyl-1'-O-[2-(3,4-dihydroxyphenyl)ethyl]-beta-D-glucopyranoside 
6'-O-acetylpaeoniflorin 
6'-O-galloylalbiflorin 
6,7-dihydrobiopterin +  
6,7-dihydroxy-4-methylcoumarin 
6-(2-amino-2-carboxyethyl)-4-hydroxybenzothiazole 
6-(alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol +  
6-(N-acetyl-alpha-D-glucosaminyl)-1-phosphatidyl-1D-myo-inositol(1-) 
6-[1'-oxo-3'(R)-hydroxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran 
6-[1'-oxo-3'(R)-methoxy-butyl]-5,7-dimethoxy-2,2-dimethyl-2H-1-benzopyran 
6-amino-2-oxohexanoic acid +  
6-anilino-5,8-quinolinedione  
6-azauridine +   
6-azauridine 5'-monophosphate 
6-azauridine 5'-monophosphate(2-) 
6-diazo-5-oxo-L-norleucine 
6-hydroxyluteolin 7-O-laminaribioside 
6-hydroxymethyladenine 
6-hydroxypaclitaxel  
6-lactoyl-5,6,7,8-tetrahydropterin +  
6-methoxyspirotryprostatin B 
6-methyladenine 
6-O-methyl-2-deprenylrheediaxanthone B 
6-O-phosphonato-D-glucono-1,5-lactone(2-) 
6-oxoprostaglandin F1alpha  
6-propyl-2-thiouracil  
6beta-hydroxycortisol  
6beta-hydroxycortisone 
6beta-hydroxytestosterone +   
7,3',4'-trihydroxy-3,8-dimethoxyflavone 
7,4'-dimethylkaempferol 
7,8-dehydrocerberin 
7,8-dihydroneopterin +  
7,8-dihydroneopterin 3'-triphosphate(4-) 
7,8-dihydroxyflavanone 
7,8-dihydroxyflavone 
7,9-dihydro-1H-purine-2,6,8(3H)-trione +   
7-(2-amino-2-carboxyethyl)-5-hydroxy-2H-1,4-benzothiazine-3-carboxylic acid 
7-(2-amino-2-carboxyethyl)-5-hydroxy-3,4-dihydro-2H-1,4-benzothiazin-3-one 
7-(4''-hydroxy-3''-methoxyphenyl)-1-phenyl-4E-heptene-3-one 
7-(4''-hydroxy-3''-methoxyphenyl)-5-methoxy-1-phenyl-3-heptanone 
7-deacetyl-7-benzoylgedunin 
7-deacetylgedunin 
7-dehydrodesmosterol 
7-epiclusianone 
7-methoxydeoxymorellin 
7-methylguanine +   
7-nor-ergosterolide 
7-oxo-10alpha-cucurbitadienol 
7-oxo-3,8,9-trihydroxy staurosporine 
7-oxo-5alpha-cholestan-3beta-ol 
7-oxo-8,9-dihydroxy-4'-N-demethyl staurosporine 
7-oxolithocholic acid +   
7-PAHSA 
7-PAHSA(1-) 
7-phloroeckol 
7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oic acid +  
7alpha,12alpha-dihydroxy-5beta-cholestan-3-one 
7alpha,12alpha-dihydroxycholest-4-en-3-one 
7alpha,25-dihydroxy-4-cholesten-3-one 
7alpha,25-dihydroxycholesterol 
7alpha,26-dihydroxycholesterol +  
7alpha-hydroperoxy manool 
7alpha-hydroxy-3-oxo-4-cholestenoic acid 
7alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid 
7alpha-hydroxy-5beta-cholestan-3-one 
7alpha-hydroxycholest-4-en-3-one  
7alpha-hydroxydehydroepiandrosterone 
8,8a-epoxymorellic acid 
8-(2-chloro-3,4,5-trimethoxybenzyl)-2-fluoro-9-pent-4-yn-1-yl-9H-purin-6-amine 
8-acetoxy-4,10-dihydroxy-2,11(13)-guaiadiene-12,6-olide 
8-aminooctanoic acid 
8-azaguanine +   
8-epi-prostaglandin E2  
8-epihelenalin 
8-epiinuviscolide 
8-hydroxy-2-(1'-hydroxyethyl)naphtho-[2,3-b]-furan-4,9-dione 
8-hydroxyadenine 
8-nitroguanosine 3',5'-cyclic monophosphate 
8-oxoadenine 
8-oxoresolvin D1 
8-PAHSA 
8-PAHSA(1-) 
8-PIP-cAMP 
9(11)-dehydroaxinysterol 
9(S)-HPODE 
9,10-epoxyoctadecanoic acid +  
9-beta-D-arabinofuranosylguanine +  
9-cis-retinoate 
9-cis-retinoic acid +   
9-deacetoxyfumigaclavine C 
9-HODE +   
9-hydroxy hedychenone 
9-hydroxycanthin-6-one  
9-hydroxyellipticine  
9-methoxycanthin-6-one 
9-PAHSA 
9-PAHSA(1-) 
9alpha,11alpha-dihydroxyergosta-4,6,8(14),22-tetraen-3-one 
9E,11E-octadecadienoic acid +   
9H-purine-2,6-diamine +  
[des-Phe(8), des-Arg(9)]-bradykinin 
[Pyr1]apelin-12(2+) 
[Pyr1]apelin-13(2+) 
A2-32-01 
A2-58-06 
abarelix 
abiraterone +   
abiraterone acetate 
absinthin 
abyssinone A 
abyssinone C 
abyssinone D 
Ac-Asp-Glu  
acadesine +   
acetaldehyde +   
acetate +   
acetoacetate 
acetoacetyl-CoA(4-) 
acetone +   
acetyl aleuritolic acid 
acetyl dihydrogen phosphate 
acetyl-CoA(4-) 
acetylcholine +   
acivicin  
aclacinomycin A  
aclacinomycin A zwitterion 
aclacinomycin N 
aclacinomycin S 
aclacinomycin S zwitterion 
aclacinomycin T 
aclacinomycin T hydrochloride 
aclacinomycin T zwitterion 
acriflavinium chloride 
acronycine 
acrovestone +  
acrylate +   
acryloyl-CoA(4-) 
acteoside  
actinodaphnine 
aculeatol E 
acumitin 
acyl-carrier protein +  
acylglycerone phosphate +  
adenine +   
adenine arabinoside +   
adenosine +   
adenosine 3',5'-bismonophosphate(4-) 
adenosine 5'-monophosphate(2-) +  
adonixanthin 
ADP +   
ADP alpha-D-glucoside(2-) 
ADP(3-) +  
ADP-alpha-D-mannose 
ADP-D-ribose 2'-phosphate(4-) 
ADP-D-ribose(2-) +  
adrenaline +   
afatinib +   
afatinib dimaleate 
afimoxifene  
aflatoxin B1 +   
aflatoxin B1 exo-8,9-epoxide  
afzelin  
agathisflavone  
ageladine A  
agigenin +  
aglaiabbreviatin F 
agmatinium(2+) 
agnuside 
AICA ribonucleotide  
aklavinone +   
alantolactone +   
alatolide 
albizoside A 
albizoside B 
albizoside C 
aldehydo-D-xylose +  
aldehydo-L-iduronate 
aldehydo-N-acetyl-D-glucosamine 
aldehydo-N-acetyl-D-mannosamine 
aldosterone +   
alectinib  
alectinib hydrochloride 
alfuzosin +   
all-cis-5,8,11,14,17-icosapentaenoate +  
all-cis-5,8,11,14,17-icosapentaenoic acid +  
all-cis-docosa-4,7,10,13,16,19-hexaenoic acid +   
all-cis-docosa-7,10,13,16-tetraenoic acid +   
all-cis-icosa-8,11,14-trienoic acid +  
all-cis-icosa-8,11,14-trienoyl-CoA 
all-trans-4-hydroxyretinoic acid +   
all-trans-4-oxoretinol  
all-trans-acitretin  
all-trans-dodecaprenyl diphosphate 
all-trans-dodecaprenyl diphosphate(3-) 
all-trans-retinal +   
all-trans-retinoate +  
all-trans-retinoic acid +   
A retinoic acid in which all four exocyclic double bonds have E- (trans-) geometry.
all-trans-retinol +   
allantoate 
allantoin +   
allanxanthone C 
alliin +   
alliin zwitterion 
allocholic acid +  
allyl isothiocyanate  
allyl octadecyl oxalate 
Aloe C-glucosylchromone 
Aloe emodin  
alpha,alpha-trehalose +   
alpha-(4-hydroxyphenyl)-N-tert-butylnitrone 
alpha-aminobutyrate 
alpha-aminobutyric acid +  
alpha-cubebene 
alpha-D-galactose 1-phosphate(2-) 
alpha-D-glucosamine 6-phosphate 
alpha-D-glucose 1,6-bisphosphate 
alpha-D-glucose 1,6-bisphosphate(4-) 
alpha-D-glucose 1-phosphate(2-) 
alpha-D-glucose-1,2-((13)C2) 
alpha-D-glucosyl-(1->3)-beta-D-mannose 
alpha-D-mannose 1-phosphate(2-) 
alpha-D-mannosyl-beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
alpha-D-ribofuranose 5-phosphate 
alpha-D-ribose 1-phosphate(2-) 
alpha-L-Fuc-(1->2)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1->1')-Cer +  
alpha-linolenate +  
alpha-linolenoyl-CoA 
alpha-maltotriose +  
alpha-Man-(1->2)-alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->3)-[alpha-Man-(1->2)-alpha-Man-(1->6)]-alpha-Man-(1->6)]-beta-Man-(1->4)-beta-GlcNAc-(1->4)-alpha-GlcNAc(PP-Dol) 
alpha-mangostin  
alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine +   
alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine(1-) +  
alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->3)-N-acetyl-alpha-D-galactosaminyl group 
alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->3)-beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer +  
alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-GlcNAc-(1->3)-beta-D-Gal-(1->4)-D-Glc-(1<->1')-Cer 
alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)-beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer 
alpha-Neu5NAc-(2->8)-alpha-Neu5NAc-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer 
alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->3)-beta-D-GalpNAc-(1->4)-[alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->3)]-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer +  
alpha-Neup5NAc-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->3)-beta-D-Galp-(1->4)-beta-D-Glcp-(1<->1')-Cer 
alpha-peltatin +  
alpha-phenylglycine +   
alpha-pinene oxide 
alsterpaullone  
alvaradoin E 
alvaradoin F 
alvaradoin G 
alvaradoin H 
alvaradoin I 
alvaradoin J 
alvaradoin K 
alvaradoin L 
alvaradoin M 
alvaradoin N 
alvocidib  
alvocidib hydrochloride 
AM-251  
amburoside A 
AMG-208 
AMG-925 
amifostine  
aminoglutethimide +   
aminomalonic acid  
ammonioacetone 
ammonium +   
amomol A 
amrubicin +  
amrubicinol 
amsacrine  
anastrozole +   
ancitabine  
ancitabine hydrochloride 
andrographolide  
androst-4-ene-3,17-dione +   
androst-5-ene-3beta,17beta-diol  
androstane-3,17-dione +   
androsterone +   
androsterone 3-glucosiduronic acid  
androsterone sulfate 
angiotensin (1-9) 
angiotensin (1-9) dizwitterion 
angiotensin I 
angiotensin I dizwitterion 
angiotensin-(1-5) dizwitterion 
ansamitocin P3 
anthramycin 
anthranilate +  
anthranilic acid +   
anti-inflammatory drug +   
antrocapmphin A 
antroquinonol  
apelin-12 
apelin-13 
apelin-16(6+) 
apelin-17(6+) 
aphidicolin  
apigenin +   
aplysinoplide A 
aplysinoplide B 
aplysinoplide C 
apo-[acyl-carrier protein] 
apratoxin A 
apratoxin D 
apratoxin E 
aquacob(III)alamin 
arabinitol +  
arachidonate +   
arachidonic acid +   
arachidonoyl-CoA(4-) 
ardisianoside A 
ardisianoside B 
ardisianoside C 
ardisianoside D 
ardisianoside E 
ardisiphenol A 
ardisiphenol B 
ardisiphenol C 
arenamide A 
arenamide B 
arglabin +  
arjunolic acid +   
aromaticin 
arotinoid acid  
artocarpin 
artochamin C 
artoindonesianin E1 
artoindonesianin P 
AS-I-145 
AS1842856 
ascidiathiazone A 
ascidiathiazone B 
ascochlorin 
ascofuranone 
ascorbate +  
Asp-Tyr-Met-Gly-Trp-Met-Asp-Phe-NH2 
aspalathin  
asperfuranone 
aspergillide A 
aspergillide B 
aspergillide C 
asperphenamate  
aspirin-triggered protectin D1 
aspirin-triggered resolvin D1 
aspirin-triggered resolvin D2 
aspirin-triggered resolvin D3 
aspirin-triggered resolvin D4 
aspirin-triggered resolvin D5 
aspirin-triggered resolvin D6 
asprellic acid A 
asprellic acid C 
astaxanthin  
astilbin  
astragaloside IV  
asukamycin 
AT7867 
ATP(3-) 
ATP(4-) +  
atromentin 
auraptene  
aureothin 
austocystin D 
autoinducer +   
axitinib  
azadiradione +   
azadirone +  
azaserine 
azathioprine  
AZD-8055 
bacillithiol 
baicalein +   
baicalein(1-) 
bassianolide 
bauhinoxepin F 
bauhinoxepin I 
BAY 60-6583  
BCI-215 
BDA-366 
BE-54238A 
BE-54238B 
beauvericin  
behenate +  
belinostat  
bellidin +  
benfotiamine  
benzothiazine +   
benzyl alcohol +   
beraprost  
beraprost sodium 
berberine  
berkeleydione 
beta-alanine +   
beta-aminopropionitrile +   
beta-aminopropionitrile hemifumarate 
beta-carotene +   
beta-casochemotide-1 
beta-casomorphin-6 (human) 
beta-casomorphin-7 (human) 
beta-casomorphin-7 (human)(1-) 
beta-citrylglutamic acid 
beta-cryptoxanthin +  
beta-D-fructofuranose 2,6-bisphosphate  
beta-D-fructofuranose 2,6-bisphosphate(4-) 
beta-D-galactosyl-(1->3)-N-acetyl-D-galactosaminyl group 
beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1)-N-acylsphingosine +  
beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-(hexacosanoyl)sphingosine 
beta-D-galactosyl-1,3-(N-acetyl-beta-D-glucosaminyl-1,6)-N-acetyl-D-galactosaminyl group 
beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(1-) +  
beta-D-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer +  
beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
beta-elemene +  
beta-Gal-(1->3)-beta-GalNAc-(1->4)-[alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->8)-alpha-Neu5Ac-(2->3)]-beta-Gal-(1->4)-beta-Glc-(1<->1')-Cer 
beta-ionone +   
beta-lapachone  
beta-leucine +  
beta-myrcene  
beta-peltatin 
beta-thujaplicin  
betaine aldehyde 
betamethasone phosphate 
betulin +   
betulinic acid +   
bexarotene  
BF 4 
BF 5 
BF 6 
BGJ-398 
BGT226 
BGT226 free base 
bianfugenine 
bicalutamide  
bielschowskysin 
bigelovin 
BIIB021 
bilirubin IXalpha  
bilirubin(2-) 
biliverdin +   
biliverdin hydrochloride 
biliverdin(2-) 
binimetinib 
biochanin A +   
biotin +   
biotin amide 
biotinate +  
biotinyl-5'-AMP 
bis(2-methylundecan-2-yl) disulfide 
bis(beta-glucosyluronate)bilirubin 
bis(S-citronellalthiosemicarbazonato)nickel(II) 
bisantrene 
bistratamide E 
bistratamide F 
bistratamide G 
bistratamide H 
bistratamide I 
bistratamide J 
bixin +   
BKM120 
bleomycin A2  
bleomycin A5  
bleomycin B2 
bleomycin hydrochloride 
BML-210 
BMS-754807  
borrelidin  
bortezomib  
bosutinib +   
bosutinib hydrate 
bowdichione 
BPDZ 711 
brasilicardin A 
brasiliquinone A 
brasiliquinone B 
brasiliquinone C 
brasixanthone B 
brasixanthone C 
brasixanthone D 
brassicasterol +  
brazilein  
brazilin  
brevipolide A 
brevipolide B 
brexanolone 
breynceanothanolic acid 
bromophycolide A 
bromotopsentin 
bruceanol D 
bruceanol E 
bruceanol F 
bruceine D 
bruceolide +  
bryostatin 1  
bryostatin 2  
buddlenol E 
bufalin  
burrodin 
burseran 
busulfan  
butan-1-ol +   
butein  
butin +  
butrin 
butyl hexanoate 
butylated hydroxyanisole  
butyrate +   
butyryl-CoA(4-) 
c-di-GMP  
cabazitaxel  
cabergoline  
cabozantinib +   
cabozantinib malate 
cadiyenol 
caerulomycin A 
caerulomycin C 
caerulomycin F 
caerulomycin G 
caerulomycin H 
caerulomycin I 
caerulomycin J 
caerulomycin K 
caerulomycinamide 
caerulomycinonitrile 
cafestol  
caffeic acid +   
calcidiol +   
calciol +   
calcitetrol 
calcitriol +   
calcium(2+) +   
calicheamicin gamma1(I) 
callophycoic acid A 
callophycoic acid C 
callophycoic acid D 
callophycoic acid E 
callophycoic acid F 
callophycoic acid G 
callophycoic acid H 
callophycol A 
callophycol B 
calotropone 
calycosin +   
calycosin(1-) 
camptothecin  
canertinib  
cannabigerol  
capecitabine  
capilliposide B 
capsiate  
carbamoyl phosphate(2-) 
carbon dioxide  
carbon monoxide  
carbonarone A 
carboplatin  
carboxyacetyl-[acyl-carrier protein] 
carcinine 
cardiolipin +  
cardivin A 
cardivin B 
cardivin C 
cardivin D 
carfilzomib  
carlinoside 
carminomycin +  
carmustine  
carnitine +   
carnitinium +  
carnosic acid  
carnosine +   
carpesiolin 
caseamemebrol A 
caseamemebrol B 
caseanigrescen A 
caseanigrescen B 
caseanigrescen C 
caseanigrescen D 
castanospermine 
catiguanin A 
catiguanin B 
caudatin-3-O-beta-cymaropyranoside 
cauloside D 
CBL0137 
CCT-018159 
CCT251545 
CD532 
CDP(3-) +  
CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol 
CDP-1-palmitoyl-2-arachidonoyl-sn-glycerol(2-) 
CDP-1-stearoyl-2-arachidonoyl-sn-glycerol 
CDP-1-stearoyl-2-arachidonoyl-sn-glycerol(2-) 
CDP-1-stearoyl-2-linoleoyl-sn-glycerol 
CDP-1-stearoyl-2-linoleoyl-sn-glycerol(2-) 
CDP-1-stearoyl-2-oleoyl-sn-glycerol 
CDP-1-stearoyl-2-oleoyl-sn-glycerol(2-) 
CDP-choline  
CDP-diacylglycerol(2-) +  
CDP-ethanolamine(1-) 
celastrol  
celebixanthone +  
cembra-2,7,11-triene-4,6-diol 
cenicriviroc 
centaureidin 
cerberin 
ceritinib  
cerotate +  
cetrorelix +   
cetrorelix acetate 
CG-1521 
CGP-42112A  
CGS 15943  
CGS-21680  
CH5126766 
chaetoglobosin B 
chaetoglobosin D 
chaetoglobosin E 
chaetoglobosin F 
chaetoglobosin G 
chaetoglobosin J 
chaetoglobosin L 
chaetoglobosin Q 
chaetoglobosin T 
chelerythrine  
chenodeoxycholate +  
chenodeoxycholic acid +   
chenodeoxycholoyl-CoA 
chitin  
chlorambucil  
chloride +   
chlorotrianisene  
cholate +   
cholest-4-en-3-one +   
cholesta-5,7-dien-3beta,24S-diol 
cholesta-5,7-dien-3beta,25-diol 
cholesta-5,7-dien-3beta-ol +   
cholestanol 7alpha,8alpha-epoxide 
cholesterol +   
cholesterol sulfate  
cholesteryl acetate 
cholesteryl linoleate  
cholesteryl palmitate  
cholic acid +   
choline +   
choline alfoscerate 
choline phosphate(1-) 
choloyl-CoA(4-) 
chondramide A +  
chondramide B 
chondramide C +  
chondramide D 
chrysin +   
chrysophanol +   
chrysosplenol C 
CHZ868 
cidofovir anhydrous +   
cidofovir dihydrate 
CIGB-300 
ciglitazone  
ciliatamide B 
cirsilineol 
cis,cis-2-amino-3-(3-oxoprop-1-enyl)but-2-enedioate 
cis,cis-2-ammonio-3-(3-oxoprop-1-enyl)but-2-enedioate(1-) 
cis-3-hydroxy-D-proline 
cis-9-nonadecenoic acid 
cis-aconitate(3-) 
cis-dodec-3-enoyl-CoA(4-) 
cis-resveratrol 3-O-glucuronide 
cisplatin  
citraconic acid  
citramalate(2-) +  
citramalic acid +  
citrifolinoside 
cladoniamide G 
cladribine  
clarinoside 
clavulone II  
cleomiscosin A 
clethroidoside C 
clethroidoside D 
clethroidoside F 
clionastatin A 
clionastatin B 
clodronic acid  
clofarabine  
clofibric acid +   
CMP-N-acetyl-beta-neuraminate(2-) 
CMP-N-glycoloyl-beta-neuraminate(2-) 
CNDAC +  
cob(I)alamin 
cob(II)alamin 
cobamamide +   
cobimetinib  
cobimetinib fumarate 
cocaine(1+) +  
cochinchinone A 
cochinchinone B 
cochinchinone C 
cochinchinoxanthone 
coenzyme A(4-) +  
coenzyme Q10  
colpol 
columbianadin 
comazaphilone D 
comazaphilone E 
comazaphilone F 
conferol A 
conferol B 
confertin 
coproporphyrin I 
coproporphyrin III 
coproporphyrinogen I 
coproporphyrinogen III(4-) 
cordycepin triphosphate 
cordyol C 
corilagin  
CORM 3 
corticosterone +   
cortisol +   
cortisol 21-sulfate 
cortisone +   
corynoline 
costunolide +   
coumarin +   
coumermycin A1 
coumestrol +   
crassolide 
crassumolide A 
cratoxyarborenone A 
cratoxyarborenone B 
cratoxyarborenone C 
cratoxyarborenone D 
cratoxyarborenone E 
cratoxyarborenone F 
creatine +   
creatinine  
crenolanib 
crizotinib +   
crocetin +   
crocin-1  
crotonoyl-CoA(4-) 
cryogenine 
cryptolepine  
cryptopleurine 
CTP(4-) +  
cucurbitacin E 2-O-beta-D-glucopyranoside 
cucurbitacin I +   
cudraflavone B  
cudraflavone C 
cudratricusxanthone A 
cumingianoside A 
cumingianoside B 
cumingianoside C 
cumingianoside D 
cumingianoside E 
cumingianoside F 
curacozole 
curcumin +   
CX-5461 
cyanate +   
cyanidin cation +   
cyclo(L-His-L-Pro) 
cyclodepsipeptide 2 
cyclomontanin A 
cyclomontanin C 
cyclomontanin D 
cyclophosphamide +   
cyclophosphamide hydrate 
cyclotetradecane +  
cysteamine +   
cysteaminium 
cystine +   
cystine zwitterion +  
cystodytin D +  
cystodytin E +  
cystodytin F 
cystodytin G 
cystodytin H 
cystodytin I 
cystothiazole A 
cytarabine  
cytidine +   
cytidine 5'-monophosphate +   
cytidine 5'-monophosphate(2-) +  
cytochalasin D  
cytoglobosin C 
cytoglobosin D 
cytosine +   
cytotrienin A 
D-alaninate 
D-alanine +   
D-alaninium 
D-allopyranose +  
D-argininium(1+) +  
D-aspartate(1-) +  
D-erythrose 4-phosphate  
D-erythrose 4-phosphate(2-) 
D-fructose 6-phosphate(2-) 
D-galactonate +  
D-galactono-1,4-lactone +  
D-galactopyranose 1-phosphate +   
D-galactose +   
D-glucarate(2-) +  
D-glucaric acid +  
D-glucitol +   
D-gluconate +  
D-glucopyranose +   
D-glucopyranose 6-phosphate(2-) +  
D-glucopyranuronate +  
D-glucosamine +   
D-glucosamine 6-phosphate +   
D-glucosyl-N-acylsphingosine +  
D-glucuronate +  
D-glucuronate 1-phosphate 
D-glucurono-6,3-lactone  
D-glyceraldehyde +   
D-kynurenine 
D-mannitol 1-phosphate 
D-mannose 1-phosphate +  
D-o-tyrosine +  
D-ornithinium(1+) 
D-pipecolate 
D-pipecolic acid 
D-prolinate 
D-prolinium +  
D-prolinol 
D-psicose +  
D-ribose +   
D-ribosylnicotinate 
D-ribulose +  
D-ribulose 5-phosphate(2-) 
D-serine +  
D-tagatofuranose 1,6-bisphosphate(4-) 
D-tagatofuranose 6-phosphate(2-) 
D-thioproline 
D-threitol  
D-xylulose +   
D-xylulose 5-phosphate(2-) +  
dabrafenib +   
dabrafenib mesylate 
dacarbazine  
dacomitinib  
dactolisib  
dADP +  
dADP(3-) 
daidzein +   
daidzein(1-) 
daphnoretin 
dasatinib (anhydrous) +  
dasatinib monohydrate 
dATP(4-) 
daunorubicin +   
davidigenin 
dCDP 
dCDP(3-) +  
dCTP +   
deacetyltanghinin 
deamido-NAD(+) +   
debrisoquin +   
decane-1,2-diol 
decanoate +  
decanoic acid +   
decanoyl-[acyl-carrier protein] 
decanoyl-CoA(4-) +  
decursinol 
dehydro-D-arabinono-1,4-lactone 
dehydroascorbide(1-) 
dehydrocostus lactone  
dehydrodiconiferyl alcohol +  
dehydroepiandrosterone +   
dehydroepiandrosterone sulfate  
dehydroepiandrosterone sulfate(1-) +  
DEL-22379 
delanzomib 
delphinidin +   
delphinidin(1-) 
Delta(12)-prostaglandin J3 
Delta(9)-tetrahydrocannabinolic acid  
demethoxycurcumin  
demethylzeylasteral 
deoxycholate +  
deoxycholoyl-CoA(4-) 
deoxyhypusine +  
deoxypodophyllotoxin  
deoxyribonucleic acid +  
dequalinium +   
dequalinium chloride 
desferrioxamine E 
desmosterol +   
devazepide  
dexamethasone +   
dexormaplatin 
dexrazoxane hydrochloride 
dGDP(3-) 
dGTP  
DH334 
DH334(1+) +  
diallyl disulfide  
diallyl trisulfide  
diandraflavone 
dianversicoside A 
dianversicoside B 
dianversicoside C 
dianversicoside D 
dianversicoside E 
dianversicoside F 
dianversicoside G 
diarsenic trioxide  
diazepinomicin 
diaziquone  
diazomethane 
dibenzo[a,l]pyrene  
dibenzothiophene +   
dibenzoylmethane +   
dicerandrol A 
dicerandrol B 
dicerandrol C 
diethylstilbestrol +   
diflomotecan 
diglyceride +   
dihomolinoleate 
dihomolinoleic acid +  
dihydroferulate 
dihydroferulic acid +  
dihydrofolate(2-) 
dihydrogen +   
dihydrolipoamide +   
dihydrolipoate +  
dihydrolipoic acid +   
dihydrolipoylprotein 
dihydromotuporamine C 
dihydroxyacetone +   
dihydroxyacetone phosphate  
diinsinin 
diinsininol 
dilopholide 
dinochrome A 
dioscin  
diosgenin +   
diosmetin +   
diosmin  
dioxygen +   
diphenylamine +   
diphosphate(3-) +  
diplotrin B 
dipsacussaponin A 
disodium cytidine 5'-monophosphate 
disulfiram  
dITP(4-) 
diuvaretin 
DMH1 
docetaxel anhydrous +  
docetaxel trihydrate 
docosahexaenoic acid +   
dodecamethylpentasiloxane 
dodecanedioate(2-) 
dodecanedioic acid +   
dolichol +   
dolichyl beta-D-glucosyl phosphate 
dolichyl D-mannosyl phosphate +  
dolichyl diphosphate 
dolichyl phosphate(2-) 
dopa +   
dopamine +   
dopaminium(1+) 
doxazosin +   
doxifluridine  
dromostanolone propionate 
dTDP(3-) 
dTDP-4-dehydro-6-deoxy-alpha-D-glucose(2-) 
dTDP-4-dehydro-6-deoxy-L-mannose(2-) 
dTDP-alpha-D-glucose(2-) +  
dTDP-L-rhamnose +  
dTMP(2-) +  
dTTP(4-) 
dUDP(3-) 
dUMP(2-) +  
dUTP +  
dynorphin A-(1-12)(4+) 
dynorphin A-(1-13)(5+) 
dyspropterin +  
E-3810 
E-3810 free base 
ebselen  
ecgoninium methyl ester(1+) 
eckol +   
edaravone  
edelfosine  
EI-1511-3 
EI-1511-5 
EI-1625-2 
ekatetrone 
elaeodendroside B 
elaeodendroside F 
elaeodendroside G 
elaeodendroside T 
elaeodendroside U 
elaeodendroside W 
elaidylphosphocholine 
elephantin 
elesclomol +   
elesclomol-Cu(II) 
elisidepsin 
ellagic acid +   
ellipticine  
elongatol A 
elongatol E 
emarginatine B 
emarginatine F 
embelin +   
emetine +   
emetine dihydrochloride +  
emetine dihydrochloride hydrate 
emodin +   
emodin(1-) 
enasidenib 
englerin A 
enrofloxacin  
ent-kaur-16-en-19-oic acid 
entinostat +   
enzalutamide 
epi-maslinic acid 
epi-silvestrol 
epi-tulipinolide 
epiandrosterone +  
epiandrosterone sulfate 
epiandrosterone sulfate(1-) 
epicatechin 3-O-(3'-O-methylgallate) 
epidihydrocholesterin 
epitestosterone +   
epothilone A  
epothilone B  
epoxyazadiradione +  
equilenin  
erdasporine A 
erdasporine B +  
erdasporine C 
ergolide 
ergosterol peroxide  
ergothioneine +   
eribulin 
eribulin mesylate 
eriocitrin 
eriodictoyl-7-O-sophoroside 
erlotinib +   
erlotinib hydrochloride  
erucamide  
erybraedin A 
erythritol +  
erythro-4-hydroxy-L-glutamate(1-) 
erythro-5-hydroxy-L-lysine 
erythro-5-hydroxy-L-lysinium(1+) 
erythronate +  
erythronic acid +  
esculeoside A 
esculetin +   
esculin +  
esculin hydrate 
esperamicin A1 
estetrol 
estra-1(10),4-diene-2,3,17-trione 
estra-1,5(10)-diene-3,4,17-trione 
estradiol +   
estramustine +   
estriol +   
estrone +   
estrone 3-O-(beta-D-glucuronide)  
estrone 3-sulfate  
estrone 3-sulfate(1-) 
etanidazole  
ethanol +   
ethanolamine +   
ethanolaminium(1+) +  
ethoxide +  
ethyl 2-methylbutyrate 
ethyl 3,4-dihydroxybenzoate  
ethyl linoleate 
ethyl linolenate 
ethyl methanesulfonate  
ethyl phenylglyoxylate 
ethyl trans-caffeate  
ethyl vanillin  
ethylamine +   
ethylmalonic acid +   
etidronate disodium 
etidronic acid  
etoposide  
etretinate 
eucalyptal A 
eucalyptal B 
eucalyptal C 
eugeniin 
eupaheliangolide A 
eupatilin  
eupatolide 
eupatorin  
euphornin L 
eurycomanone  
eurysterol A 
eurysterol A sulfonic acid 
eurysterol B 
eurysterol B sulfonic acid 
everolimus  
exemestane  
F390B 
F390C 
FAD  
FADH2(2-) +  
fangchinoline  
farnesoic acid +   
fazarabine 
FD-211 
ferricytochrome b5 
ferricytochrome c +  
ferrocytochrome c +  
ferroheme b +   
ferruginol +  
ferulic acid +   
fingolimod +  
fingolimod phosphate 
firocoxib 
fisetin +   
flavalin A 
flavokawain B  
floribundasaponin A 
floxuridine  
fludarabine phosphate 
fluoxymesterone  
flutamide  
FMN +   
FMN(3-) +  
folic acid +   
food antioxidant +   
formate +  
formestane  
formycin A +  
formyl-CoA(4-) 
fotemustine  
FR901463 
FR901464 
FR901465 
fraxetin +   
fraxin 
fructosylglycine 
fruticoside A 
fucodiphloroethol G 
fucoidan  
fucosterol +   
fulvestrant  
fumarate(2-) +  
fusarithioamide A 
fuzanin D 
FX1 
G-573 
galactarate(1-) 
galactarate(2-) 
galactaric acid +   
galactitol +  
galactonic acid +  
gallic acid +   
gamma-aminobutyrate +   
gamma-aminobutyric acid +   
gamma-CEHC +  
gamma-CEHC beta-glucuronide 
gamma-Glu-Gln 
gamma-Glu-Gln(1-) 
gamma-Glu-Glu 
gamma-Glu-Glu(2-) 
gamma-Glu-Gly 
gamma-Glu-Ile 
gamma-Glu-Leu 
gamma-Glu-Met 
gamma-Glu-Met(1-) 
gamma-Glu-Tyr 
gamma-Glu-Tyr(1-) 
gamma-Glu-Val 
gamma-Glu-Val(1-) 
gamma-glutamyl-Se-methylselenocysteine 
gamma-glutamylphenylalanine 
gamma-glutamylthreonine +  
gamma-linolenate +  
gamma-linolenic acid +   
gamma-linolenoyl-CoA(4-) 
gamma-mangostin  
gamma-terpinene +   
gamma-tocotrienol 
GANT61 
garciniaxanthone F 
garciniaxanthone G 
garciniaxanthone H 
gartanin 
gastrin-17  
gaudichaudiic acid F 
gaudichaudiic acid G 
gaudichaudiic acid H 
gaudichaudiic acid I 
GDC-0879 
GDP(3-) +  
GDP-4-dehydro-6-deoxy-alpha-D-mannose(2-) 
GDP-alpha-D-mannose +  
GDP-alpha-D-mannose(2-) 
GDP-glucose +   
GDP-L-fucose(2-) 
gedunin +   
gefitinib +   
geldanamycin +   
gelomulide K 
gelomulide M 
gemcitabine +   
gemcitabine hydrochloride 
gemini-0072 
gemini-0097 
Genipin  
genistein +   
gentisyl alcohol 
geranyl diphosphate(3-) 
geranyl phosphate 
ghrelin  
GI254023X 
gibberellin A1(1-) 
gibberosin K 
gibberosin L 
gigantetronenin 
gigantrionenin 
gilteritinib 
gilvusmycin 
gingerol  
ginkgetin  
ginkgolide B  
ginsenoside C-K  
ginsenoside F2  
ginsenoside Mc 
ginsenoside Mx 
ginsenoside Rb3 
ginsenoside Re  
ginsenoside Rf  
glasdegib 
glionitrin A 
globostellatic acid A 
globostellatic acid B 
globostellatic acid C 
globostellatic acid D 
globosumone A 
globosumone B 
globosuxanthone A 
glochierioside A 
glochierioside B 
Glu-Cys 
Glu-Trp 
glucarate(2-) +  
glucaric acid +   
glucuronic acid +   
glutaconate(2-) +  
glutaconic acid +  
glutarate(1-) +  
glutarate(2-) +  
glutaric acid +   
glutaryl-CoA(5-) 
glutathionate(1-) +  
glutathione +   
glutathione disulfide(2-) 
glutaurine 
Gly-Phe zwitterion 
Gly-Val 
glyceraldehyde 3-phosphate +   
glyceraldehyde 3-phosphate(2-) 
glycerate +  
glycerol +   
glycerol 1-phosphate +   
glycerone phosphate(2-) 
glycochenodeoxycholate +  
glycochenodeoxycholic acid +   
glycocholate +  
glycocholic acid  
glycodeoxycholate +  
glycodeoxycholic acid +   
glycohyocholate 
glycohyocholic acid 
glycolaldehyde +   
glycolate +  
glycolic acid +   
glycolithocholate 
glycylglycine 
glycylglycine zwitterion 
glycyrol  
glyoxylate +  
glyoxylic acid +   
gnidilatimonoein 
gondamide 
gondoate 
gordonoside I 
gordonoside J 
gordonoside K 
gordonoside L 
gordonoside M 
gordonoside N 
gordonoside O 
gordonoside P 
granaticin 
grandiflorenic acid 
grassypeptolide 
graveolide 
griffithane A 
griffithane B 
griffithane D 
GSK1059615 
GSK2656157  
GSK690693  
GTP(4-) +  
GTRI-02 
guanazole 
guangsangon K 
guangsangon L 
guangsangon M 
guangsangon N 
guanidinoacetic acid 
guanine +   
guanosine 5'-monophosphate(2-) +  
gummiferaoside A 
gummiferaoside B 
gummiferaoside C 
HA15 
hadacidin 
HC toxin 
hederagenin 28-O-beta-D-glucopyranoside 
hedychilactone D 
helenalin  
heliangin 
heparan sulfate  
herbacetin  
hesperetin +   
hexadecan-1-ol +  
hexadecanal +  
hexadecanedioate(2-) 
hexadecanedioic acid +  
hexadecanoate +   
hexanoate +   
hexanoic acid +   
hexanoyl-CoA +   
HG-9-91-01 
hinokiflavone  
hippeastrine 
hispidin  
hispidulin  
histamine +   
histaminium 
histrelin +  
histrelin acetate 
holo-[acyl-carrier protein] 
holomycin +  
holothurin A3 
holothurin A4 
homocysteine zwitterion 
homocystine +  
homocystine zwitterion +  
homogentisate 
homogentisic acid 
homovanillate 
homovanillic acid +   
hordenine 
horminone +  
HU-308  
human blood serum metabolite +   
human urinary metabolite +   
human xenobiotic metabolite +   
humulone 
hyaluronic acid  
hydrazinocurcumin 
hydrogen cyanide +   
hydrogen sulfide +   
hydrogencarbonate +   
hydrogensulfite +   
hydroquinone +   
hydrosulfide +  
hydroxidodioxidosulfidosulfate(1-) 
hydroxyacetone +  
hydroxysafflor yellow A  
hydroxytyrosol +   
hydroxyurea  
hygrolidin 
hyodeoxycholate 
hyodeoxycholic acid +   
hyperforin  
hyperxanthone C 
hyperxanthone E 
hypochlorous acid +   
hypocrellin D 
hypolaetin +  
hypotaurine +   
hypothemycin 
hypothiocyanous acid 
ibrutinib  
icariin  
icariside II  
icosanoate +  
icosanoyl-CoA +  
icosatetraenoic acid +   
ICRF-193 
idebenone  
idelalisib  
IDP(3-) 
iduronic acid +  
ifosfamide  
igalan 
ikarugamycin +  
Ile(5)-angiotensin II  
Ile(5)-angiotensin II dizwitterion 
Ile-Ile 
ilomastat  
imatinib +  
imatinib methanesulfonate 
imidazol-4-ylacetate 
imidazole-4-acetaldehyde 
imiquimod  
IMP +   
IMP(2-) +  
indanomycin 
indicanone 
indisulam 
indol-3-ylacetaldehyde  
indole +   
indole-3-acetate 
indole-3-acetic acid +   
indole-3-carboxylic acid +   
indole-3-methanol +   
indoxyl sulfate  
ingenol mebutate 
inosine +   
inuchinenolide B 
inuchinenolide C 
inumakilactone 
inumakilactone B 
inuviscolide  
iodide +   
iodine atom +   
irilone +   
irilone-4'-O-[beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside] 
irinotecan  
irinotecan hydrochloride (anhydrous) +  
irinotecan hydrochloride hydrate 
iron(2+) +   
iron(3+) +   
isariotin F 
isethionic acid  
isobrucein A 
isobutrin 
isobutyrate +  
isobutyric acid anhydride 
isobutyryl-CoA +   
isobutyryl-CoA(4-) 
isocaproic acid +   
isochamuvaritin 
isocitrate(3-) +  
isoferulic acid +  
isoflavipucine 
isoginkgetin 
isoiguesterin 
isoliquiritin 
isolithocholic acid 
isomaltose +  
isonicotinic acid +   
isooctanediol dibutyrate 
isoorientin +   
isopentenyl diphosphate  
isopentenyl diphosphate(3-) 
isopropyl dodecanoate 
isopropyl palmitate  
isorhamnetin 3-O-robinobioside 
isoscutellarein glycoside 
isostrychnine 
isotretinoin  
isoursodeoxycholic acid 
isovaleryl-CoA(4-) +  
isowigtheone hydrate 
itaconate(2-) 
itaconic acid +  
itaconyl-CoA(5-) 
ITP +  
ITP(3-) 
ivosidenib 
ixabepilone 
ixazomib +   
ixazomib citrate 
ixerochinolide 
jacarelhyperol A 
jaceosidin  
jadomycin B 
jaspamide  
jaspamide B 
jaspamide C 
jaspamide D 
jaspamide E 
jaspamide F 
jaspamide G 
jaspamide H 
jaspamide J 
jaspamide K 
jaspamide L 
jaspamide M 
jaspamide N 
jaspamide O 
jaspamide P 
jasplakinolide D 
jasplakinolide Q 
jasplakinolide R1 
jerantinine A +  
jerantinine B 
jerantinine C +  
jerantinine D 
jerantinine E 
jerantinine F 
jineol 
JM335 
JP-8g 
JQ1 
juglanin A 
juglanin B 
JWH-133 
kadlongilactone A 
kadlongilactone B 
kaempferol 3,7-di-O-alpha-L-rhamnoside 
kaempferol 3-O-(5-O-acetyl-alpha-D-apiofuranosyl)-7-O-alpha-L-rhamnopyranoside 
kaempferol 3-O-alpha-L-[6'''-p-coumaroyl-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside] 
kaempferol 3-O-alpha-L-[6'''-p-coumaroyl-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside]-7-O-beta-D-glucopyranoside 
kaempferol 7-O-(2,3-di-E-p-coumaroyl-alpha-L-rhamnopyranoside) 
kaempferol 7-O-(2-E-p-coumaroyl-alpha-L-rhamnopyranoside) 
kahweol  
kalopanaxsaponin A  
kalopanaxsaponin B 
kalopanaxsaponin C 
kansuiphorin A 
kansuiphorin B 
keto-phenylpyruvate 
Ki11502 
kidjoranin-3-O-alpha-diginopyranosyl-(1->4)-beta-cymaropyranoside 
kidjoranin-3-O-beta-digitoxopyranoside 
kievitone +  
kinetensin 
kinetensin (1-8) 
kinetensin (1-8)(2+) 
kinetensin(2+) 
kisspeptin-54 
kitastatin 1 
klymollin C 
klymollin D 
klymollin E 
klymollin F 
klymollin G 
klymollin H 
knipholone +  
koshikamide A2 
KP1019 
Ku-0063794  
kurarinol  
kuwanone G  
kweichowenol B 
kynurenate 
kynurenic acid +   
kynurenine +   
L-2-amino-3-oxobutanoic acid 
L-2-aminoadipate(1-) 
L-2-aminoadipic acid +  
L-4-hydroxyglutamic semialdehyde 
L-alloisoleucine +  
L-allysine +  
L-alpha-aminobutyric acid +  
L-arabinitol +  
L-arabinose +  
L-argininium(1+) +  
L-ascorbate +  
L-asparagine +   
L-aspartate(1-) +  
L-canaline 
L-citrulline +  
L-citrulline zwitterion +  
L-cystathionine  
L-cysteate(1-) +  
L-cysteic acid 
L-cysteine +   
L-cysteine glutathione disulfide 
L-cysteine hydrochloride +  
L-cysteine hydrochloride hydrate 
L-cysteinylglycine +  
L-cysteinylglycine zwitterion 
L-cystine +   
L-cystine anion 
L-dopa +  
L-dopa(1-) +  
L-dopachromate 
L-dopaquinone 
L-erythrulose +  
L-fucopyranose 1-phosphate +  
L-fucose +  
L-fuculose +  
L-galactonate +  
L-gamma-Glu-L-Thr 
L-gamma-Glu-L-Thr(1-) 
L-gamma-glutamyl phosphate(2-) 
L-gamma-glutamyl-L-cysteinate(1-) 
L-gamma-glutamyl-L-cysteine +   
L-glutamate(1-) +   
L-glutamic 5-semialdehyde +  
L-glutamine +   
L-gulonate +  
L-gulono-1,4-lactone 
L-histidine +   
L-histidinol +  
L-homoarginine  
L-homocarnosine 
L-homocitrulline +  
L-homocitrulline zwitterion 
L-homocysteine thiolactone 
L-homoserine +  
L-iditol 
L-isoleucine +   
L-kynureninate 
L-kynurenine +  
L-leucine +   
L-lysine +   
L-lysine zwitterion 
L-methionine +   
L-o-tyrosine +  
L-ornithinate +  
L-ornithinium(2+) 
L-pipecolate 
L-pipecolic acid +  
L-prolinate +  
L-prolinium +   
L-saccharopinate(1-) 
L-saccharopine 
L-selenocysteine +   
L-serine +   
L-sorbose +  
L-threonate 
L-threonine +   
L-thyroxine +  
L-tryptophan +   
L-tryptophanamide +  
L-valine +   
L-xylonate 
L-xylulose +  
lactate +  
lactobionic acid +  
lactose +   
lanost-8-ene-3beta,30-diol  
lanosterol +   
lapatinib  
lasofoxifene  
laurebiphenyl 
lauroyl-CoA(4-) +  
LDC4297 
leachianone A 
leflunomide  
lehualide F 
lehualide G 
lehualide H 
lehualide I 
lejimalide A 
lejimalide B 
lenalidomide  
lenvatinib 
lenvatinib mesylate 
letrozole  
Leu-Leu 
leucospiroside A 
leukotriene A4(1-) 
leukotriene B4 +   
leukotriene B4(1-) 
leukotriene B5  
leukotriene C4 +   
leukotriene C4(2-) 
leukotriene D4  
leukotriene E4(1-) 
leukotriene F4 
leuprolide +   
leuprolide acetate 
levoglucosan 
lificiguat 
ligstroside 
limonene +   
linifanib 
linoleamide  
lipoamide +   
lipoate +  
lipoxin A4 +   
lipoxin B4 +  
lipoyl-AMP(1-) +  
lipoylprotein 
liquiritin  
liriodenine 
lissoclibadin 1 
lissoclibadin 2 
lissoclibadin 3 
lithocholate +  
lithocholic acid +   
lithocholyl-CoA 
LLP-3 
loganin +   
lomustine  
lonafarnib  
lonazolac 
lonazolac calcium 
longicalycinin A 
longirostrerone A 
longirostrerone B 
longirostrerone C 
longirostrerone D 
lonidamine +   
Lonsurf 
lorlatinib 
lovastatin +   
LRRK2-IN-1 
lucanthone +   
lucialdehyde B 
lucialdehyde C 
lucidenic acid N  
lucidumoside C 
lugdunin 
luminespib 
lupulin A 
lupulone 
luteolin +   
luteolin 7-O-beta-D-glucoside +   
luzonial A 
luzonial B 
luzonidial B 
LY-2157299  
lychnostatin 1 
lychnostatin 2 
lycopene +   
lyratol C 
lyratol D 
lysikokianoside 1 
lysophosphatidylcholine +   
lysophosphatidylcholine 20:2 +  
lysophosphatidylcholine 20:5 +  
lysophosphatidylcholine 22:4 +  
lysophosphatidylcholine(0:0/16:0) +  
lysophosphatidylcholine(0:0/16:1) +  
lysophosphatidylcholine(0:0/18:0) +  
lysophosphatidylcholine(0:0/18:2) +  
lysophosphatidylcholine(0:0/20:4) +  
lysophosphatidylcholine(0:0/20:5) 
lysophosphatidylcholine(16:1/0:0) +  
lysophosphatidylcholine(18:0/0:0) 
lysophosphatidylcholine(18:2/0:0) +  
lysophosphatidylcholine(20:4/0:0) +  
lysophosphatidylethanolamine 16:0 +  
lysophosphatidylethanolamine 18:2 +  
m-tyraminium 
maackiaflavanone A 
maackiaflavanone B 
maackiapterocarpan A 
macabarterin 
macaflavanone G 
macaranone A 
macluraxanthone B 
macluraxanthone C 
madecassic acid +   
madecassoside  
magnoshinin 
mallotophilippen A 
mallotophilippen B 
mallotophilippen C 
mallotophilippen D 
malonate(2-) +  
malonic acid +   
malonyl-CoA(5-) 
maltose +   
manassantin A 
manassantin B 
mangicol A 
mangiferin  
mannarate(2-) +  
mannaric acid +  
manniflavanone 
mannioside A 
mannitol +   
manool 
manzamine A +  
maoecrystal Z 
marimastat  
marineosin A 
marineosin B 
marmesinin 
martefragin A 
masitinib 
maslinic acid +   
masoprocol  
maytansine +  
maytenfolone A 
MCB-613 
mechlorethamine hydrochloride 
meclofenamic acid  
medroxyprogesterone acetate  
megathyrin A 
megestrol +   
megestrol acetate  
melatonin +   
melittin  
melophlin P 
melophlin Q 
melophlin R 
melophlin S 
melphalan  
menatetrenone +   
mercaptopurine +   
mertansine 
mesaconate(2-) 
mesaconic acid +  
mesaconyl-CoA 
meso-2,6-diaminopimelic acid +  
meso-2,6-diaminopimelic acid dizwitterion 
meso-3,3'-didemethoxynectandrin B 
meso-tetrakis(N-methyl-4-pyridyl)porphine tetrakis(p-toluenesulfonate) 
meso-tetrakis(N-methyl-4-pyridyl)porphine(4+) +   
meso-zeaxanthin 
metachromin S 
metachromin T 
methacrylyl-CoA  
methanethiol +   
methanol +   
methionine S-oxide +  
metholone +  
methotrexate  
methoxide 
methoxsalen +   
methoxyacetic acid  
methyl (indol-3-yl)acetate 
methyl 3,4,5-trihydroxybenzoate  
methyl 3,4-dihydroxybenzoate 
methyl 4,23,29-trihydroxy-3,4-seco-olean-12-en-3-oate-28-oic acid 
methyl 5-aminolevulinate +  
methyl 5-aminolevulinate hydrochloride 
methyl gamma-linolenate 
methyl icosapentaenoate 
methyl phenylglyoxalate 
methyl vanillate +  
Methyl violet 2B 
Methyl violet 2B free base 
methylammonium +  
methylcobalamin  
methylene blue  
methylene group 
methylglyoxal +   
methylmalonate(1-) 
methylmalonate(2-) 
methylmalonic acid +   
methylmalonyl-CoA +  
methylprednisolone suleptanate 
methylselenenic acid 
methylseleninic acid  
methylselenol 
methylsuccinic acid 
methyltestosterone  
miboplatin 
michaolide A 
michaolide B 
michaolide C 
michaolide D 
michaolide E 
michaolide F 
michaolide G 
michaolide H 
michaolide I 
michaolide J 
michaolide K 
miconazole +   
miconazole nitrate 
microclavatin 
midazolam +   
midazolam hydrochloride 
midostaurin  
migrastatin 
miltefosine  
minabeolide 1 
minabeolide 2 
minabeolide 4 
minabeolide 5 
minabeolide 8 
minheryin G 
minquartynoic acid 
miquelianin  
mithramycin  
mitoguazone 
mitoguazone hydrochloride +  
mitoguazone hydrochloride hydrate 
mitomycin A 
mitomycin B 
mitomycin C  
mitoxantrone +   
mitoxantrone dihydrochloride 
ML240 
MMP-9-IN-1 
mogrol +  
mollicellin B 
mollicellin C 
mollicellin E 
mollicellin F 
mollicellin H 
mollicellin J 
mollicellin K 
mollicellin L 
mollicellin M 
mollicellin N 
momelotinib 
monascin  
monascorubrin 
monastrol 
mono(glucosyluronic acid)bilirubin(2-) 
monoacylglycerol 14:0 +  
monoacylglycerol 16:0 +  
monoacylglycerol 16:1 +  
monoacylglycerol 18:0 +  
monoacylglycerol 18:1 +   
monoacylglycerol 18:2 +  
monoacylglycerol 18:3 +  
monoacylglycerol 20:5 +  
monodehydro-L-ascorbate(1-) 
monodictyochromone A 
monodictyochromone B 
monodictysin B 
monodictysin C 
monotropein  
morellic acid +  
morellin +  
morin  
moromycin A 
moromycin B 
morusin  
motixafortide 
MTIC 
mucronulatol 
multifidol glucoside 
multiflorin B 
multinoside A 
murideoxycholate 
murideoxycholic acid 
mycophenolic acid +   
myo-inositol +   
myo-inositol 1,3,4,5,6-pentakisphosphate(10-) 
myo-inositol 1,3,4,6-tetrakisphosphate(8-) 
myo-inositol 1,3-bisphosphate 
myo-inositol hexakisphosphate  
myo-inositol hexakisphosphate(12-) 
myriaporone 3 
Myricanone 
myricetin +   
myricitrin-5-methyl ether 
myriocin  
myristamide 
myristoyl-[acyl-carrier protein] 
myristoyl-CoA(4-) +  
myrsinoic acid A 
myrsinoic acid B 
myrsinoic acid C 
myrsinoic acid F 
N(1),N(12)-diacetylsperminium(2+) 
N(1),N(12)-diethylspermine  
N(1)-(5-phospho-D-ribosyl)glycinamide(1-) +  
N(1)-acetylspermidinium(2+) 
N(1)-acetylspermine 
N(1)-acetylsperminium(3+) 
N(1)-isopropyl-2-methylpropan-1,2-diamine 
N(2),N(2)-dimethylguanosine 
N(2)-([biphenyl]-4-ylsulfonyl)-N-hydroxy-N(2)-isopropoxy-D-valinamide 
N(2)-acetyl-L-lysine 
N(2)-acetyl-L-lysine zwitterion 
N(2)-acetyl-L-ornithine 
N(2)-acetyl-L-ornithine zwitterion 
N(2)-formyl-N(1)-(5-phospho-D-ribosyl)glycinamide(2-) +  
N(2)-methylguanine 
N(2)-phenylacetyl-L-glutaminate 
N(2)-phenylacetyl-L-glutamine 
N(4)-\{N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->2)-alpha-D-mannosyl-(1->6)]-beta-D-mannosyl-(1->4)-N-acetyl-beta-D-glucosaminyl-(1->4)-[alpha-L-fucosyl-(1->6)]-N-acetyl-beta-D-glucosaminyl\}-L-asparagine 
N(5)-[(Z)-amino(hydroxyimino)methyl]ornithine +  
N(6),N(6),N(6)-trimethyl-L-lysine +  
N(6)-(1,2-dicarboxylatoethyl)-AMP(4-) 
N(6)-(Delta(2)-isopentenyl)adenosine +  
N(6)-acetyl-L-lysine +  
N(8)-acetylspermidine 
N(8)-acetylspermidinium(2+) 
N(alpha)-acetyl-L-arginine +  
N(pros)-methyl-L-histidine +  
N(tele)-methyl-L-histidine +  
N(tele)-methylhistamine  
N(tele)-methylhistaminium 
N,N'-diacetylchitobiose +  
N,N'-diacetylchitobiosyldiphosphodolichol 
N,N'-diphenyl-1,4-phenylenediamine  
N,N-dimethylacetamide 
N,N-dimethylethanolamine phosphate 
N,N-dimethylglycine  
N-(15Z-tetracosenoyl)ethanolamine 
N-(2-[(2-aminoethyl)(methyl)amino]-5-\{[3-cyano-7-(cyclopropylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino\}phenyl)acetamide 
N-(2-furoyl)glycinate 
N-(2-furoyl)glycine 
N-(2-methoxyethyl)-4-\{[6-(pyridin-4-yl)quinazolin-2-yl]amino\}benzamide 
N-(2-methylbutanoyl)glycine 
N-(4-coumaroyl)-L-homoserine lactone 
N-(5-\{[(5-tert-butyl-1,3-oxazol-2-yl)methyl]sulfanyl\}-1,3-thiazol-2-yl)piperidine-4-carboxamide 
N-[(9-beta-D-ribofuranosylpurin-6-yl)carbamoyl]threonate 
N-[(9-beta-D-ribofuranosylpurin-6-yl)carbamoyl]threonine 
N-[(9Z)-hexadecenoyl]glycine 
N-[(E)-4-ammoniobutylidene]propane-1,3-diaminium 
N-[(R)-4-phosphonatopantothenoyl]-L-cysteinate(3-) 
N-[(R)-pantothenoyl]-L-cysteinate 
N-\{4-[(3-bromophenyl)amino]quinazolin-6-yl\}but-2-ynamide 
N-acetyl-alpha-D-glucosamine 1-phosphate 
N-acetyl-beta-D-galactosaminyl-(1->3)-alpha-D-galactosyl-(1->4)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide +  
N-acetyl-beta-D-glucosaminyl-(1->3)-beta-D-galactosyl-(1->4)-beta-D-glucosylceramide(d18:1(4E)) +  
N-acetyl-beta-D-glucosaminyl-(1->3)-N-acetyl-D-galactosaminyl group +  
N-acetyl-beta-D-glucosaminyl-1,6-(N-acetyl-beta-D-glucosaminyl-1,3)-N-acetyl-D-galactosaminyl group 
N-acetyl-D-galactosamine +  
N-acetyl-D-galactosamine 1-phosphate +  
N-acetyl-D-glucosamine 6-phosphate +  
N-acetyl-D-glucosamine 6-phosphate(2-) +  
N-acetyl-D-glucosaminyldiphosphodolichol 
N-acetyl-D-mannosamine 6-phosphate(2-) 
N-acetyl-L-2-aminoadipic acid 
N-acetyl-L-alanine +  
N-acetyl-L-aspartate(2-) +  
N-acetyl-L-aspartic acid +   
N-acetyl-L-cysteinate 
N-acetyl-L-cysteine +   
N-acetyl-L-gamma-glutamyl phosphate(3-) 
N-acetyl-L-glutamate(2-) +  
N-acetyl-L-glutamic acid 
N-acetyl-L-glutamine 
N-acetyl-L-isoleucinate 
N-acetyl-L-serine +  
N-acetylcadaverine 
N-acetylglycinate +   
N-acetylglycine +  
N-acetylhistamine 
N-acetylisoleucine +  
N-acetylneuraminate +  
N-acetylneuraminic acid +   
N-acetylneuraminic acid 9-phosphate 
N-acetylputrescinium 
N-acetylserotonin  
N-acyl-beta-D-galactosylsphingosine +  
N-acylsphinganine +   
N-acylsphingosine +   
N-acylsphingosine 1-phosphate(2-) +  
N-arachidonoyl-2-oxoserotonin 
N-arachidonoylglycinate 
N-arachidonoylserotonin 
N-benzoylglycinate 
n-butyl oleate 
N-butylformamide 
N-carbamoyl-beta-alaninate 
N-carbamoyl-L-aspartate(2-) 
N-carbamoylaspartic acid +  
N-carbamoylglutamic acid 
N-desmethylenzalutamide 
N-docosanoyltaurine 
N-ethyl-5'-carboxamidoadenosine  
N-formimidoyl-L-glutamate(2-) +  
N-formyl-L-kynurenine +  
N-formylanthranilate 
N-glycoloylneuraminate +  
N-hexacosahexaenoylsphingosine 
N-hexadecanoylglycine +  
N-hexadecanoylsphinganine-1-phosphocholine 
N-hydroxyguanidine 
N-isopropyl-N'-phenyl-p-phenylenediamine  
N-isovaleryl-L-homoserine lactone 
N-methylbutan-2-amine 
N-methylethanolaminium phosphate(1-) 
N-methylphenylethanolamine 
N-methylphenylethanolaminium 
N-methylproline 
N-methylproline zwitterion 
N-methylputrescinium(2+) 
N-methylserotonin 
N-methyltyraminium 
N-octadecanoylglycine 
N-oleoyltaurine 
N-palmitoyl-S-[2,3-bis(palmitoyloxy)propyl]-Cys-Ser-Lys-Lys-Lys-Lys  
N-phosphocreatinate(2-) 
N-phosphocreatine 
N-propylbenzamide 
N-ribosylnicotinamide  
NAD(1-) +  
NADH(2-) +  
NADP(3-) 
NADPH(4-) +  
nagilactone F 
nandrolone +   
naphthazarin  
naringin  
narirutin 
nataloe-emodin +  
navitoclax  
nelarabine 
nelfinavir  
nelfinavir mesylate 
neobavaisoflavone +   
neocarzinostatin chromophore 
neocasomorphin 
neohesperidin 
neophytadiene 
neratinib  
neurotensin  
neurotensin (1-12) 
neurotensin (1-12)(1+) 
neurotensin (1-7) 
neurotensin (1-8) 
neurotensin(1+) 
nezukol 
nicotinamide +   
nicotinate D-ribonucleotide(2-) 
nicotinic acid-adenine dinucleotide phosphate  
nidulalin A 
nifedipine  
nigerapyrone B 
nigerapyrone D 
nigerapyrone E 
nigerloxin 
nigranoic acid 
nilotinib  
nilutamide  
nimustine  
nimustine hydrochloride 
ninhydrin 
nintedanib  
nintedanib esylate 
nitensidine E 
nitric oxide  
nitrite +   
nitrosulindac 
NK154183A 
NK154183B 
NMN(-) 
nobiletin  
nociceptin  
nocodazole  
nogalamycin 
nolinospiroside F 
nonanal +   
nonanedioic acid +   
norathyriol +   
nordazepam  
nordihydroguaiaretic acid +   
norlaudanosoline +   
nortriptyline  
norwogonin 
notoginsenoside R1  
NS-398  
Nutlin +   
O(4')-sulfo-L-tyrosinate(1-) 
O(4')-sulfo-L-tyrosine 
O(4)-methylthymine 
O-(2-aminoethyl)-L-serine 
O-(2-tetradecenoyl)carnitine 
O-(3-hydroxyvaleryl)-L-carnitine 
O-(chloroacetylcarbamoyl)fumagillol  
O-(dimethylnonenoyl)carnitine 
O-[(5Z)-tetradecenoyl]-L-carnitine 
O-acetyl-L-carnitine  
O-acetylcarnitine +   
O-butanoylcarnitine +   
O-decanoyl-L-carnitine 
O-dodecanoylcarnitine +  
O-glutaroyl-L-carnitine 
O-heptadecanoylcarnitine 
O-hexanoyl-L-carnitine 
O-hexanoylcarnitine +  
O-isobutyryl-L-carnitine 
O-isobutyrylcarnitine +  
O-isovalerylcarnitine +  
O-linoleyl-L-carnitine 
O-methylserotonin +   
O-octadecanoyl-L-carnitine 
O-octanoyl-L-carnitine 
O-oleoylcarnitine 
O-palmitoyl-L-carnitine 
O-phospho-L-serine +  
O-phosphoethanolamine +  
O-phosphonato-L-homoserine(2-) 
O-phosphonato-L-serine(2-) +  
O-phosphonatoethanaminium(1-) 
O-phosphonatooxy-D-serine(2-) 
O-phosphoserine +  
O-propanoylcarnitine +  
O-stearoylcarnitine 
O-succinylcarnitine 
O-tetradecanoyl-L-carnitine 
O-tiglylcarnitine +  
o-tyrosine 
O-undecenoylcarnitine 
obochalcolactone 
obolactone 
obyanamide 
ochrocarpin A 
ochrocarpin B 
ochrocarpin C 
ochrocarpin D 
ochrocarpin E 
ochrocarpin F 
ochrocarpin G 
ochrocarpinone A 
ochrocarpinone B 
octadecadienoate +  
octadecan-1-ol +   
octadecanoate +  
octadecanoic acid +   
octanoate +  
octanoic acid +   
octanoyl-[acyl-carrier protein] 
octanoyl-CoA(4-) +  
olaparib  
oleamide  
oleanolic acid 3-O-[O-beta-D-glucopyranosyl-(1->4)-O-beta-D-glucopyranosyl-(1->3)-O-alpha-L-rhamnopyranosyl-(1->2)-alpha-L-arabinopyranoside] 
oleic acid +   
oleocanthal 
oleoyl-CoA(4-) 
oleuropein +   
oleuropein aglycone 
oligomycin A  
oligomycin D 
oltipraz  
omacetaxine mepesuccinate  
ombuin 
omega-3 fatty acid +   
omega-hydroxymenaquinone-4 
omeprazole +   
onalespib 
ophthalmic acid 
orantinib  
orbiculin A 
orbiculin E 
orbiculin F 
orbiculin G +  
oridonin  
orientin +   
ormaplatin 
ornithine +   
ornithinium(1+) +  
orobol +  
orotate +  
orotidine 5'-phosphate 
orotidine 5'-phosphate(3-) 
oroxylin A +   
oroxylin A(1-) 
oryzafuran 
osimertinib  
osimertinib mesylate 
ospemifene  
ossamycin 
OSU-03012  
oviedomycin 
ovothiol A 
ovothiol B 
ovothiol C 
oxalate(1-) +  
oxalate(2-) +   
oxalic acid +   
oxaline 
oxaliplatin +   
oxaloacetate(2-) 
oxidopamine  
oxypeucedanin hydrate acetonide 
oxyphenbutazone +   
oxyphenbutazone hydrate 
P(1),P(4)-bis(5'-adenosyl) tetraphosphate(4-) 
p-cresol +   
p-cresol sulfate 
p-cresol sulfate(1-) 
p-Glu-Arg-Pro-Arg-Leu-Ser-His-Lys-Gly-Pro-Met-Pro-Phe 
paclitaxel +   
palau'amide 
palbociclib  
pallidol  
palmitoleamide 
palmitoleate +  
palmitoleoyl ethanolamide 
palmitoleoyl-CoA(4-) 
palmitoyl-[acyl-carrier protein] 
palmitoyl-CoA(4-) 
pannarin 
panobinostat  
panobinostat lactate 
pantetheine 
pantetheine 4'-phosphate(2-) +  
papuamide B 
parabanic acid +  
paraminabeolide A 
pasireotide  
pasireotide aspartate 
pateamine 
patuletin 
pazopanib  
pazopanib hydrochloride 
PD 0325901  
PD-166866 +   
PD158780 
PD173074  
pectolinarin 
pederin 
peloruside A 
pemetrexed  
pemetrexed disodium +  
pemetrexed disodium heptahydrate 
pentamidine  
pentan-3-amine 
peonidin +   
peonidin 3-O-beta-D-glucoside 
peonidin chloride  
peptide YY 
perillic acid +   
perillyl aldehyde  
peroxynitrite 
petunidin 3-O-beta-D-glucoside 
pevonedistat  
pexidartinib 
PF-00477736  
PH 797804 
PHA-533533 
PHA-665752  
phantomolin 
phaseolotoxin 
phelligridimer A 
phenethyl caffeate  
phenethyl isothiocyanate +   
phenformin  
phenylacetaldehyde +   
phenylacetate +  
phenylacetic acid +   
phenylacetyl-CoA(4-) 
phenylacetylglycine +   
phenylacetylglycine(1-) 
phenylarsine oxide  
phenylethanolamine +  
phenylethanolaminium 
phleomycin 
phleomycin D1 +  
phloretin +   
phlorizin  
phlorizin chalcone  
phomacin A 
phomacin B 
phomacin C 
phomoxanthone A 
phomoxanthone B 
phorbol 13-acetate 12-myristate  
phosphate ion +  
phosphatidate(2-) +  
phosphatidyl-L-serine +  
phosphatidyl-N,N-dimethylethanolamine +  
phosphatidyl-N-methylethanolamine +  
phosphatidylcholine (16:0/20:5) 
phosphatidylcholine 16:2 
phosphatidylcholine 29:1 +  
phosphatidylcholine 35:3 +  
phosphatidylcholine 35:4 +  
phosphatidylcholine 36:4 +   
phosphatidylcholine 42:7 
phosphatidylethanolamine 19:1 
phosphatidylethanolamine 36:2 +  
phosphatidylethanolamine 36:3 +  
phosphatidylethanolamine 38:3 +  
phosphatidylethanolamine 38:4 +  
phosphatidylglycerol(1-) +  
phosphatidylserine 18:0 
phosphatidylserine 40:1 
phosphatidylserine 40:2 
phosphatidylserine 42:1 
phosphinic acid +  
phosphocholine +   
phosphoenolpyruvate  
phosphoric acid +   
phylloquinone +   
physalin B 
physalin D 
physalin F 
physcion +   
phytanate +  
phytanoyl-CoA(4-) 
PI-103 
piceatannol +  
piclamilast  
picolinic acid +   
picropodophyllotoxin  
pierreione A 
pierreione B 
pinellic acid 
pinobanksin 
pinocembrin +   
pipecolate +  
piperidine +   
piperlactam S 
pipobroman 
pirazofurin 
pitavastatin  
pitavastatin calcium 
PK-11195  
plaunotol  
pleosporone 
plerixafor 
plitidepsin  
plumbagin  
PLX-4720 
PM-94128 
PMX-205 
podophyllotoxin +   
poly(N-acetyllactosamine)  
polyketomycin 
pomalidomide  
ponatinib  
porfimer 
porfimer sodium 
porphobilinogen(1-) 
potassium(1+) +   
PP121 
pracinostat 
pralatrexate 
praliciguat 
prednisolone +   
prednisolone phosphate 
prednisolone sodium phosphate 
prednisone +   
pregnenolone +   
pregnenolone sulfate  
prenyl diphosphate(3-) 
prenylcandidusin A 
prenylcandidusin B 
prenylcandidusin C 
prenylterphenyllin 
prenylterphenyllin A 
prenylterphenyllin B 
prenylterphenyllin C 
presqualene diphosphate(3-) 
preuroporphyrinogen(8-) 
prinomastat  
prinomastat hydrochloride 
pristanal 
pristanic acid +  
pristanoyl-CoA +  
Pro-Hyp 
Pro-Hyp zwitterion 
proanthocyanidin A2 
probucol  
procarbazine  
procarbazine hydrochloride 
procyanidin B1 +  
procyanidin B2 +   
procyanidin B2 3'-O-gallate 
procyanidin B3 +   
procyanidin B4 +  
procyanidin C1 
procyanidin C2 
prodigiosin  
progesterone +   
proline +   
promegestone  
propionate +   
propionyl-CoA(4-) +  
propyl butyrate 
propyl propionate 
prostaglandin A1(1-) +  
prostaglandin A2 +   
prostaglandin B1  
prostaglandin B2 
prostaglandin C1(1-) 
prostaglandin C2 
prostaglandin D1 
prostaglandin D1(1-) 
prostaglandin D2 +   
prostaglandin D2 1-glyceryl ester 
prostaglandin D2(1-) 
prostaglandin D3  
prostaglandin E1 +   
prostaglandin E1(1-) +  
prostaglandin E2 +   
prostaglandin E2 1-glyceryl ester 
prostaglandin E2 2-glyceryl ester 
prostaglandin E2(1-) +  
prostaglandin E3  
prostaglandin F1alpha +   
prostaglandin F2alpha +   
prostaglandin F2alpha 1-glyceryl ester 
prostaglandin F2alpha 2-glyceryl ester 
prostaglandin F2alpha(1-) 
prostaglandin F2beta 
prostaglandin G1 
prostaglandin G1(1-) +  
prostaglandin G2 +   
prostaglandin G2 2-glyceryl ester 
prostaglandin H2 2-glyceryl ester 
prostaglandin H2(1-) 
prostaglandin H3 
prostaglandin I2 2-glyceryl ester 
prostaglandin I2(1-) +  
prostaglandin J2 +   
prostaglandin J3 +  
protectin D1 +  
protirelin 
protopanaxadiol +   
protoporphyrinate 
protoporphyrinogen(2-) 
prunetin +   
psorospermin  
psychosine +  
psychosine sulfate 
psychosine(1+) 
pterolinus A 
pterolinus B 
pterolinus D 
pterostilbene  
purine-6-thiol  
puromycin +   
purpurogallin  
putrescine +   
pyranonigrin A 
pyridoxal +   
pyridoxal 5'-phosphate +   
pyridoxal 5'-phosphate(2-) 
pyridoxal hydrochloride 
pyridoxamine +   
pyridoxamine 5'-phosphate 
pyridoxamine 5'-phosphate(1-) 
pyridoxamine dihydrochloride 
pyridoxamine hydrochloride 
pyridoxaminium(1+) +  
pyridoxatin 
pyridoxine +   
pyridoxine 5'-phosphate(2-) 
pyroglutamylglutaminate 
pyroglutamylglutamine 
pyrrolidine dithiocarbamate  
pyrvinium  
quadrangularin A 
quassimarin 
quercetagetin +   
quercetin +   
quercetin 3,4'-dimethyl ether 
quercetin 3-O-[beta-D-xylosyl-(1->2)-beta-D-glucoside] 
quercetin 3-O-alpha-L-[6'''-p-coumaroyl-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside] 
quercetin 3-O-alpha-L-[6'''-p-coumaroyl-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside]-7-O-beta-D-glucopyranoside 
quercetin 3-O-beta-D-glucopyranoside  
quercetin 3-O-beta-D-glucopyranosyl-(1->2)-rhamnopyranoside 
quercetin 3-O-beta-D-glucosyl-(1->2)-beta-D-glucoside +  
quercetin 4'-O-beta-D-glucopyranoside  
quercetin 7-O-beta-D-glucoside 
quercitrin  
quillaic acid +  
quinaldate 
quinaldic acid 
quinolinate(1-) +  
quinolinate(2-) 
quinoline-4,6-diol 
quinoline-4,8-diol 
quinolinic acid  
quizartinib  
rac-1-monolinoleoylglycerol 
rac-crizotinib 
rac-lisofylline 
radical scavenger +   
rataniaphenol I 
rataniaphenol II 
rataniaphenol III 
ravidomycin 
rediocide G 
regorafenib +   
regorafenib hydrate 
rel-2alpha,3alpha,23-trihydroxy-19-oxo-18,19-seco-urs-11,13(18)-dien-28-oic acid 
rel-2alpha,3beta,23-trihydroxy-19-oxo-18,19-seco-12,17-dien-28-norursane 
resolvin D1  
resolvin D1(1-) 
resolvin D2  
resolvin D3 
resolvin D4 
resolvin D5 
resolvin D6 
resolvin E1 
resolvin E1(1-) 
resolvin E2 
resolvin E3 
resolvin T1 
resolvin T2 
resolvin T3 
resolvin T4 
respirantin 
resveratrol +   
retaspimycin 
retaspimycin hydrochloride 
retinal +   
retinoic acid +   
retinoic acid receptor alpha/beta agonist +   
retinoic acid receptor beta agonist +  
retinoic acid receptor gamma agonist +   
retinol +   
retinyl palmitate +   
reumycin +  
reversine 
rhamnacene +  
rhamnetin 
rhinacanthin C 
rhizoxin 
rhosin 
ribitol +   
ribothymidine +  
ridaforolimus 
rifampicin +   
rigosertib 
rigosertib sodium 
Ro 48-8071 
Ro 48-8071 fumarate 
Ro 5-3335 
robustaflavone +  
robustaflavone 7,4',7''-trimethyl ether 
rocaglamide  
roducitabine 
rohitukine 
romidepsin  
rosmarinic acid +   
rostratin A 
rostratin B 
rostratin C 
rostratin D 
rosuvastatin  
rosuvastatin calcium  
rotenone  
rottlerin  
rotundifolioside A 
rotundifolioside H 
rotundifolioside I 
rotundifolioside J 
rotundifuran 
RU 58668  
rubiadin  
rubiarbonol G 
rubiarbonone E 19-acetate 
rubiarboside G 28-acetate 
rubimaillin  
rubitecan  
rubiyunnanol A 
rubiyunnanol B 
rubraxanthone 
rucaparib  
rutin  
ruxolitinib +  
ruxolitinib phosphate 
S(6)-acetyldihydrolipoamide +  
S(8)-(2-methylbutanoyl)dihydrolipoamide 
S(8)-(2-methylpropanoyl)dihydrolipoamide 
S(8)-(3-methylbutanoyl)dihydrolipoamide 
S(8)-aminomethyldihydrolipoylprotein 
S(8)-glutaryldihydrolipoamide 
S(8)-succinyldihydrolipoamide 
S-(2-succinyl)-L-cysteine 
S-(hydroxymethyl)glutathione(1-) 
S-adenosyl-L-methioninate  
S-adenosyl-L-methionine +   
S-adenosylmethioninaminium 
S-allylcysteine  
S-formylglutathionate(1-) 
S-formylglutathione 
S-methyl-5-thio-alpha-D-ribose 1-phosphate(2-) 
S-methyl-5-thio-D-ribulose 1-phosphate(2-) 
S-nitrosoglutathione  
S-propyl propanethiosulfinate 
S-sulfo-L-cysteine 
SAICAR(4-) 
saintopin 
salicylic acid +   
salinosporamide A 
salsalate  
salvianolic acid B  
salvileucalin B 
samaderine B 
samaderine C 
samaderine E 
samaderine X 
samaderine Y 
samaderine Z 
sapacitabine 
sappanchalcone  
sapropterin +   
sarcosinate 
sarcosine +  
sarcosinium 
satraplatin  
SB 415286  
SB220025 
SC-58125  
SC560 
SCH51344 
schaftoside 
schiprolactone A 
schizolaenone A 
schizolaenone B 
schweinfurthin G 
schweinfurthin H 
sciscllascilloside E-1 
scroside D 
scutebarbatine C 
scutebarbatine D 
scutebarbatine E 
scutebarbatine F 
scutebarbatine G 
scutellarin  
scutianthraquinone A 
scutianthraquinone B 
scutianthraquinone C 
scyllo-inositol +   
scytalidamide A 
scytalidamide B 
Se-methyl-L-selenocysteine +   
Se-methylselenocysteine +   
sebacate(2-) 
sebacic acid +   
secoaggregatalactone A 
secoxyloganin 
sedoheptulose 1,7-bisphosphate(4-) 
sedoheptulose 7-phosphate 
sedoheptulose 7-phosphate(2-) 
selenate +  
selenide +   
selenocysteine +   
selenoneine 
selenophosphate 
selumetinib  
semaxanib 
semustine  
sepantronium bromide 
serotonin +   
serotonin(1+) 
sesaminol +  
sesterstatin 1 
sesterstatin 2 
sesterstatin 3 
Sg17-1-4 
shinorine 
sibiromycin 
sieboldianoside A 
sigmoidin A 
sigmoidin B 
silibinin  
silvestrol 
simalikalactone D 
sinapine 
sinularolide B 
sinularolide C 
sinularolide D 
sinularolide E 
sirolimus +   
sirtinol  
sitoindoside IX 
sitosterol +  
skatole  
SKF-96365 hydrochloride  
SN-38 +   
sn-glycerol 3-phosphate 
sn-glycerol 3-phosphate(2-) 
sodium 2-amino-5-[(1-methoxy-2-methylindolizin-3-yl)carbonyl]benzoate 
sodium 3-hydroxybutyrate 
sodium arsenite  
sodium ascorbate 
sodium aurothiomalate  
sodium dehydroepiandrosterone sulfate 
sodium ferulate 
sodium gallate 
sodium globostellatate A 
sodium globostellatate B 
sodium globostellatate C 
sodium globostellatate D 
sodium glycochenodeoxycholate 
sodium glycodeoxycholate 
sodium glycolate 
sodium glyoxylate 
sodium hexanoate 
sodium meclofenamate monohydrate 
sodium methoxyacetate 
sodium orotate 
sodium stibogluconate  
sodium(1+) +   
solanine 
solasodine  
solasodine(1+) +  
somocystinamide A 
sonidegib +   
sonidegib phosphate 
sophoraflavanone A 
sophoraflavanone G 
sophoraflavanone L 
sorafenib +   
sorbinil  
specialised pro-resolving mediator +   
spermidine(3+) +  
spermine +   
spermine(4+) 
sphinganine +   
sphinganine 1-phosphate(1-) 
sphinganine(1+) +  
sphingomyelin d18:1(1+) 
sphingosine +   
sphingosine 1-phosphate  
sphingosine 1-phosphate(1-) 
sphingosine(1+) 
spiculoic acid A 
spiruchostatin B  
spongotine A 
squalene +   
SR9243  
stachsterol 
staphyloxanthin 
stattic  
stearoyl-CoA(4-) 
steffimycin D 
steviol +   
stevioside +   
streptokordin 
streptonigrin  
streptozocin  
strongylin A 
strongylophorine-26 
SU4312 
SU6656  
suberic acid +   
subulatin 
succinate(2-) +  
succinyl-CoA(5-) 
sucrose +   
sugiol +  
sulfate +   
sulfoglycolithocholate(2-) 
sulforaphane +   
sulindac +   
sulindac sulfide  
sunitinib +   
superoxide  
suramin  
surfactin  
surfactin A +   
surfactin B +   
surfactin C +   
surfactin D +   
swainsonine 
swertianin +  
swertianolin +  
swertisin 
SZL-P1-41 
tabernaemontanine 
tabersonine +  
tacedinaline  
tagatose 6-phosphate +  
taiwanhomoflavone A 
taiwanhomoflavone-B 
talarozole 
talmapimod 
talosin A 
tamarixetin  
tamibarotene  
tamoxifen +   
tamsulosin +   
tamsulosin hydrochloride +  
tanariflavanone D 
tandutinib 
tanespimycin  
tangeretin +   
tanghinigenin +  
tanghinin 
taraxasterol 
tasumatrol E 
tasumatrol F 
taurine +   
tauro-beta-muricholate 
tauro-beta-muricholic acid  
taurochenodeoxycholate 
taurochenodeoxycholic acid