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(+)-alpha-pinene 
(+)-alpha-viniferin  
(+)-conocarpan  
(+)-schisandrin B  
(+)-sesamin +   
(+)-SKF-10,047 
(+)-subersic acid 
(-)-antofine  
(-)-cubebin 
(-)-epigallocatechin 3-gallate +   
(-)-larreatricin 
(-)-N(6)-(2-phenylisopropyl)adenosine 
(-)-syringaresinol O,O'-bis(beta-D-glucoside) 
(-)-trans-carveol 
(10E,12Z,15Z)-9-hydroxy-10,12,15-octadecatrienoic acid methyl ester 
(10Z)-tricosene 
(11Z)-icos-11-enoic acid +  
(11Z,14Z,17Z)-icosatrienoate 
(12Z)-10-hydroxyoctadec-12-enoic acid 
(13E)-octadecenoic acid 
(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 
(14Z)-hexadecenoic acid 
(15Z)-tetracosenoate +  
(17Z)-hexacosenoic acid +  
(18R)-resolvin E3 
(18S)-resolvin E1 
(18S)-resolvin E2 
(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-aminoethyl)phosphonic acid +  
(2-hydroxyphenyl)acetate 
(2-hydroxyphenyl)acetic acid  
(2-trans,6-cis)-dodeca-2,6-dienoyl-CoA 
(20R)-17alpha,20-dihydroxycholesterol 
(20R,22R)-20,22-dihydroxycholesterol 
(20S)-20-hydroxypregn-4-en-3-one  
(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 
(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)-7alpha,24-dihydroxycholesterol 
(24S,25)-dihydroxycholesterol 
(24S,26)-dihydroxycholesterol 
(24Z),26-hydroxydesmosterol 
(25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-27-oyl taurine 
(25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oyl-CoA(4-) 
(25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-27-oyl taurine 
(25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-27-oyl taurine 
(25R)-7alpha,26-dihydroxycholest-4-en-3-one 
(25R)-cholest-5-ene-3beta,26-diol +   
(25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoyl-CoA 
(2E)-2-hexenyl isovalerate 
(2E,6R)-8-hydroxy-2,6-dimethyl-2-octenoic acid 
(2R,3S)-2-methyl-3-propyloxirane 
(2S)-2-(4-\{[(1R,2S)-2-hydroxycyclopentyl]methyl\}phenyl)propanoic acid 
(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-) 
(2Z,4E)-2-aminomuconate(2-) 
(2Z,4E)-2-ammoniomuconate(1-) 
(3,4-dihydroxyphenyl)acetate 
(3,4-dihydroxyphenyl)acetic acid +   
(3E)-2,3,4-trimethylhex-3-enal 
(3E)-2,6-dimethyloct-3-ene 
(3R,4S,1'R)-3-(1'-hydroxyethyl)-4-methyldihydrofuran-2(3H)-one 
(3R,5S)-1-pyrroline-3-hydroxy-5-carboxylic acid 
(3S)-3-hydroxy-3-methylglutaryl-CoA 
(3S)-citramalyl-CoA(5-) 
(3Z,6Z)-dodecadienoyl-CoA 
(4-hydroxy-3-methoxyphenyl)acetaldehyde 
(4-hydroxyphenyl)acetaldehyde 
(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,12E,14S,16Z,19Z,21R)-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-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)-5-[(5-\{[(4-chlorophenyl)methyl]sulfanyl\}-1-methyl-3-(trifluoromethyl)pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one 
(5Z)-tetradecenoylcarnitine 
(5Z,11Z,14Z)-icosatrienoic acid 
(5Z,8Z)-octadecadienoic 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 
(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-methyltetrahydrofolate(2-) +  
(7R,14S)-dihydroxy-(4Z,8E,10E,12Z,16Z,19Z)-docosahexaenoic acid 
(7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoic acid 
(7Z,10Z,13Z,16Z,19Z)-docosapentaenoate +  
(7Z,10Z,13Z,16Z,19Z)-docosapentaenoic acid +  
(9E)-10-nitrooctadecenoic acid 
(9E)-9-nitrooctadecenoic acid 
(9E,11E)-octadecadienoic 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)-2-dodecene +  
(E)-2-octene 
(E)-3-dodecene 
(E)-3-octene 
(E)-4-oxonon-2-enal 
(E)-dec-3-en-2-ol 
(E)-hexadec-2-enoyl-CoA(4-) 
(E,E)-germacrone  
(N(omega)-L-arginino)succinate(1-) 
(R)-2-hydroxy-4-methylpentanoate 
(R)-2-hydroxyglutaric acid 
(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)-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 
(R,R)-5,11-diethyl-5,6,11,12-tetrahydro-2,8-chrysenediol 
(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)-colchicine  
(S)-dihydroorotate 
(S)-dihydroorotic acid 
(S)-lactaldehyde 
(S)-lactic acid +   
(S)-malate(2-) +  
(S)-methylmalonyl-CoA(5-) 
(S)-propane-1,2-diol +  
(Z)-2-octene 
(Z)-2-penten-1-ol 
(Z)-3-(4-iodophenyl)-2-mercaptoacrylic acid 
(Z)-3-dodecene 
(Z)-3-octene 
(Z)-but-2-ene-1,2,3-tricarboxylate 
1,1,3,3-tetramethylurea 
1,2,3,4,6-pentakis-O-galloyl-beta-D-glucose 
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 +  
1,3,7,9-tetramethyluric acid  
1,4-butanediammonium +  
1,4-dimethylcyclohexane +  
1,4-dithiothreitol +   
1,5-anhydro-D-glucitol 
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-bromo-2-propanol 
1-chlorobutan-2-ol 
1-docosene 
1-dodecene 
1-ethyl-2-propylcyclohexane 
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-hydroxy-5-phenyl-3-pentanone 
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-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-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-palmitoleoyl-2-palmitoyl-sn-glycero-3-phosphocholine 
1-pentadecanoyl-2-[(5Z,8Z,11Z,14Z)-eicosatetraenoyl]-sn-glycero-3-phosphocholine 
1-pentadecyl-2-acetyl-sn-glycero-3-phosphocholine 
1-penten-3-one  
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-hydroxypalmitic acid 
10-nonadecenoate 
10-nonadecenoic acid +  
10-PAHSA 
10-PAHSA(1-) 
11(R)-HEPE 
11(R)-HEPE(1-) 
11-cis-retinal +  
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-O-acetylcyathatriol 
11-oxo-ETE +  
11-oxotestosterone 
11-PAHSA 
11-PAHSA(1-) 
11beta-hydroxyandrost-4-ene-3,17-dione 
11beta-hydroxyprogesterone 
11beta-PGE2 
12(S)-HETE 
12(S)-HPETE(1-) 
12-HETE +  
12-hydroxylauric acid +   
12-PAHSA 
12-PAHSA(1-) 
12alpha-hydroxy-3-oxo-5beta-cholan-24-oic acid +  
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-dihydrolipoxin A4 
13,14-dihydrolipoxin A4(1-) 
13-cis-retinal  
13-cis-retinol +  
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 +   
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-oxo-ETE +   
16(S)-HETE 
16,23,29-trihydroxy-3-oxo-olean-12-en-28-oic acid 
16alpha-hydroxydehydroepiandrosterone 
16alpha-hydroxypregnenolone 
17-defurano-17-oxosalannin 
17-phenyl-18,19,20-trinor-prostaglandin D2 
17-phenyl-18,19,20-trinor-prostaglandin E2 
17alpha-hydroxypregnenolone +   
17alpha-hydroxyprogesterone  
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 
19alpha-hydroxyasiatic acid +  
1alpha,23(S),25-trihydroxyvitamin D3 
1alpha,25-dihydroxyvitamin D2 
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-) 
2',3'-cyclic UMP(1-) 
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 
2,2-dihydroxy-3-methylbutanoate 
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-dihydroxybutanoic acid +  
2,3-diketogulonate 
2,3-epoxymenatetrenone 
2,4,4-trimethylpentane-1,3-diyl bis(2-methylpropanoate) 
2,4,6-trimethyldecane 
2,4-dihydroxy-6-methylbenzaldehyde 
2,4-dimethyl-1-heptene 
2,4-dimethylfuran 
2,4-dimethylhexane 
2,4-dimethylpentan-3-amine 
2,5-diamino-6-ribosylamino-4(3H)pyrimidinone 5'-triphosphate 
2,5-dihydroxybenzaldehyde  
2,5-dihydroxybenzoate 
2,5-dihydroxybenzoic acid +   
2,6,10,14-tetramethylheptadecane 
2,6,10,15-tetramethylheptadecane 
2,6,8-trimethyldecane 
2,7,10-trimethyldodecane 
2-((4R)-4-((3R,5R,6S,7R,9S,10R,13R,14S,17R)-3,6,7-Trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pent-2-enamido)ethane-1-sulfonic acid 
2-((4R)-4-((3R,5R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-N-methylpentanamido)ethane-1-sulfonic acid 
2-((4R)-4-((3R,5S,7R,9S,10S,13R,14R,17R)-3,7,14-Trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid 
2-((4R)-4-((3R,5S,7R,9S,10S,13S,14S,16R)-3,7,16-Trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid 
2-((4R)-4-((3R,5S,7S,9S,10S,13R,14S,17R)-3,7-Dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2,2-dimethylpentanamido)ethane-1-sulfonic acid 
2-((4R)-4-((5R,7R,8R,9S,10S,12S,13R,17R)-7,12-dihydroxy-10,13-dimethyl-3-oxohexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid 
2-((4R)-N-Benzyl-4-((3R,5S,7S,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanamido)ethane-1-sulfonic acid 
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-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran 
2-(4-methoxyphenyl)propan-2-ol 
2-(4-methyl-1-piperazinyl)ethanamine 
2-(beta-D-glucopyranosyloxy)benzoic acid 
2-[4-(3,6,7-Trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]ethanesulfonic acid 
2-[4-[(3R,7R,12S)-3,7,12-Trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoylamino]ethanesulfonic acid 
2-[[(4R)-4-[(3R,5R,8R,9S,10S,12R,13R,14S,17R)-3,12-Dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid 
2-[[(4R)-4-[(3R,5R,9S,10S,12S,13R,14S,17R)-3,12-Dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid 
2-[[(4R)-4-[(3R,5S,7R,9S,10S,12S,13R,14S,17R)-3,7,12-Trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid 
2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
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-aminoacrylic acid +  
2-aminoethanesulfonate +  
2-aminomuconate 6-semialdehyde(1-) 
2-aminooctanoic acid 
2-aminooctanoic acid zwitterion 
2-ammonio-2-deoxy-D-glucopyranose +  
2-ammonio-2-deoxy-D-glucopyranose 6-phosphate(1-) +  
2-arachidonoylglycerol +   
2-butyl-1-octanol +  
2-butylfuran 
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-ethyl-2-hexenal +  
2-ethylhydracrylate 
2-ethylhydracrylic acid 
2-formamido-N(1)-(5-O-phosphonato-D-ribosyl)acetamidine +  
2-hexylfuran 
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-hydroxyoctadecanoate +  
2-hydroxyoctadecanoic 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-methyl-5-propionylfuran 
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-octene +  
2-oxoadipate(2-) 
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(S),25-dihydroxyvitamin D3 
20-HETE +   
20-hydroxy-leukotriene B4 
20-hydroxy-leukotriene B4(1-) 
20-hydroxy-leukotriene E4(1-) 
20-hydroxycholesterol  
20beta-dihydroprednisolone 
22-hydroxyprotectin D1 
23(S),25-dihydroxy-24-oxovitamin D3 
24,25-dihydrolanosterol +   
25-hydroxycholesterol  
25-hydroxyvitamin D2 
26-hydroxycholesterol +   
2alpha,3alpha,23-trihydroxyolean-12-en-28-oic acid 
2alpha,3beta-dihydroxyolean-13(18)-en-28-oic acid 
2alpha-acetoxy-4alpha,6alpha-dihydroxy-1beta,5alphaH-guai-9(10),11(13)-dien-12,8alpha-olide 
2beta-hydroxytestosterone 
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'-AMP 
3'-AMP(2-) 
3'-dephospho-CoA 
3'-dephospho-CoA(2-) 
3'-phosphonato-5'-adenylyl sulfate(4-) 
3'-UMP(2-) 
3,13,19-trimethyltricosanoic acid 
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'-diiodo-L-thyronine +  
3,4'-dimethylkaempferol 
3,4-dihydroxybutyric acid 
3,4-dihydroxymandelaldehyde +  
3,4-dihydroxymandelate +  
3,4-dihydroxymandelic acid  
3,4-dihydroxyphenylacetaldehyde  
3,5-diiodo-L-tyrosinate(1-) 
3,5-diiodo-L-tyrosine +  
3,5-dimethylbenzaldehyde 
3,5-dimethyloctane 
3,5-dioxooctanedioic acid 
3,7,11-trimethyldodecan-1-ol 
3,7-dimethyl-3-octanol 
3,8-dimethylundecane 
3-(1H-indol-3-yl)propanoate 
3-(1H-indol-3-yl)propanoic acid  
3-(2-methylpropyl)cyclohexene 
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-(pyrimidin-2-yl)propanoic acid 
3-aminopiperidine-2-one 
3-aminopropanesulfonic 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-ethylpentane 
3-fucosyllactose +  
3-furoic acid +  
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-hydroxykynurenamine 
3-hydroxykynurenine +   
3-hydroxymandelic acid 
3-hydroxymethyl-4-methyl-furan-2(5H)-one 
3-hydroxyoctadecanoyl-CoA +  
3-hydroxyphenylpyruvic acid 
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-iodothyronamine  
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-methyleneheptane 
3-methylguanine +  
3-methylhexane 
3-methylhistidine 
3-methylhistidine zwitterion 
3-methylmalate(2-) 
3-methylmalic acid +  
3-methylpentane 
3-methylpyrrolo[1,2-a]pyrazine 
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-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-penten-1-yne +  
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-ureidoisobutyric acid 
3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-oyl-CoA +  
3alpha,7alpha,12alpha,24-Tetrahydroxy-5beta-cholestan-27-oyl taurine 
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,12alpha-trihydroxy-5beta-cholestane-5-carboxylic 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,7beta-dihydroxy-12-oxo-5beta-cholanic acid 
3alpha-hydroxy-5beta-androstan-17-one +   
3alpha-hydroxy-5beta-androstan-17-one 3-glucosiduronic acid 
3alpha-hydroxy-5beta-pregnan-20-one  
3alpha-sulfotaurodeoxycholate(2-) 
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-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  
4',6,7-trihydroxyisoflavone 
4'-hydroxychalcone  
4,4-dimethyl-5alpha-cholesta-8,14,24-trien-3beta-ol  
4,5,9,10-dehydroisolongifolene 
4,6,8-trimethyl-1-nonene 
4,6-dimethyldodecane 
4,6-dimethylundecane 
4,6-dioxoheptanoic acid  
4,8,12-trimethyltridecanoyl-CoA(4-) 
4-(2-aminophenyl)-2,4-dioxobutanoate 
4-(trimethylammonio)butanoate  
4-(trimethylammonio)butanoic acid +  
4-acetamidobutanal 
4-acetamidobutanoate 
4-amino-TEMPO +   
4-ammoniobutanal 
4-coumaric acid methyl ester +  
4-coumaroyl-CoA(4-) +  
4-epiisoinuviscolide 
4-ethylphenyl sulfate 
4-ethylphenyl sulfate(1-) 
4-fumarylacetoacetate(2-) 
4-hexen-3-one +  
4-hydroxy-2-oxoglutarate(2-) +  
4-hydroxy-L-prolinate 
4-hydroxy-L-proline zwitterion 
4-hydroxy-TEMPO +   
4-hydroxycordoin 
4-hydroxynon-2-enal +   
4-hydroxyphenylacetate 
4-hydroxyphenylacetic acid +   
4-hydroxyphenylpyruvic acid +  
4-hydroxyproline +  
4-maleylacetoacetate 
4-methoxy-17beta-estradiol +   
4-methoxyestrone +  
4-methoxytyramine  
4-methyl-2-oxopentanoate 
4-methyl-2-oxopentanoic acid  
4-methylcatechol +   
4-methylpentanal  
4-methylthio-2-oxobutanoate +  
4-methylundecane 
4-nitrophenyl hydrogen sulfate  
4-O-methyl-L-dopa 
4-oxobutanoate 
4-pyridoxate 
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-) 
5,5-dimethyl-1-pyrroline N-oxide  
5,6,7,8-tetrahydrobiopterin +   
5,6-dihydrothymine 
5,6-dihydrouracil 
5,6-dihydroxyindole-2-carboxylate +  
5,6-dimethylbenzimidazole 
5,6-trans-vitamin D3 
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-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->4)-[6-deoxy-alpha-L-galactopyranosyl-(1->3)]-D-glucopyranose 
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->6)-[beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->6)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose +  
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-aminopentanoic acid +  
5-diphospho-1D-myo-inositol pentakisphosphate 
5-dodecenoate 
5-dodecenoic acid +  
5-formamido-1-(5-phospho-D-ribosyl)imidazole-4-carboxamide(2-) 
5-formimidoyltetrahydrofolate(2-) 
5-formyluracil 
5-guanidino-2-oxopentanoic acid 
5-hydroperoxy-15-HETE +  
5-hydroxy-L-tryptophan 
5-hydroxy-N-formylkynurenine +  
5-hydroxybenzimidazole 
5-hydroxyindole  
5-hydroxyisouric acid +  
5-hydroxykynurenine +  
5-hydroxymethyluracil +  
5-hydroxytryptophan +   
5-methoxytryptamine +   
5-methyl-2-furaldehyde 
5-methylcytosine +   
5-methyldec-1-ene 
5-methyltetrahydrofolic acid +   
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-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 
6'-O-acetylpaeoniflorin 
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-amino-2-oxohexanoic acid +  
6-deoxy-alpha-L-galactopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)]-D-glucopyranose 
6-hydroxymethyladenine 
6-lactoyl-5,6,7,8-tetrahydropterin +  
6-methyladenine 
6-O-phosphonato-D-glucono-1,5-lactone(2-) 
6-oxoprostaglandin F1alpha  
6alpha-methylprednisolone +   
6beta-hydroxycortisol  
6beta-hydroxycortisone 
6beta-hydroxytestosterone +   
7,8-dihydroneopterin +  
7,8-dihydroneopterin 3'-triphosphate(4-) 
7,8-dimethoxyflavone 
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-chlorokynurenic acid  
7-deacetylgedunin 
7-dehydrodesmosterol 
7-epiclusianone 
7-ketocholesterol  
7-methylguanine +   
7-oxo-10alpha-cucurbitadienol 
7-oxo-5alpha-cholestan-3beta-ol 
7-oxolithocholic acid +   
7-oxotaurodeoxycholic acid 
7-oxotaurolithocholic acid 
7-PAHSA 
7-PAHSA(1-) 
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-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 
7beta-hydroxyepiandrosterone 
8-aminooctanoic acid 
8-epi-prostaglandin E2  
8-epihelenalin 
8-epiinuviscolide 
8-hydroxyadenine 
8-nitroguanosine 3',5'-cyclic monophosphate 
8-oxoadenine 
8-oxoresolvin D1 
8-PAHSA 
8-PAHSA(1-) 
9(S)-HPODE 
9,10-epoxyoctadecanoic acid +  
9-HODE +   
9-PAHSA 
9-PAHSA(1-) 
[des-Phe(8), des-Arg(9)]-bradykinin 
[Pyr1]apelin-12(2+) 
[Pyr1]apelin-13(2+) 
absinthin 
ABT-737  
abyssinone I 
Ac-Asp-Glu  
Ac-Tyr-Val-Ala-Asp-chloromethylketone 
acaulide 
acetaldehyde +   
acetate +   
acetoacetate 
acetoacetyl-CoA(4-) 
acetone +   
acetyl dihydrogen phosphate 
acetyl-CoA(4-) 
acetylcholine +   
acrylate +   
acryloyl-CoA(4-) 
acteoside  
acyl-carrier protein +  
acylglycerone phosphate +  
adenine +   
adenosine +   
adenosine 3',5'-bismonophosphate(4-) 
adenosine 5'-monophosphate(2-) +  
ADP +   
ADP alpha-D-glucoside(2-) 
ADP(3-) +  
ADP-alpha-D-mannose 
ADP-D-ribose 2'-phosphate(4-) 
ADP-D-ribose(2-) +  
adrenaline +   
aflatoxin B1 +   
aflatoxin B1 exo-8,9-epoxide  
afzelin  
agmatinium(2+) 
agnuside 
AICA ribonucleotide  
ajugaciliatin B 
ajugamarin A1 chlorohydrin 
ajugamarin A2 chlorohydrin 
akebia saponin D 
albiflorin +   
aldehydo-D-xylose +  
aldehydo-L-iduronate 
aldehydo-N-acetyl-D-glucosamine 
aldehydo-N-acetyl-D-mannosamine 
aldosterone +   
alendronate sodium trihydrate 
alendronic acid  
alfacalcidol  
all-cis-5,8,11,14,17-icosapentaenoate +  
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-dodecaprenyl diphosphate 
all-trans-dodecaprenyl diphosphate(3-) 
all-trans-retinal +   
all-trans-retinoate +  
all-trans-retinoic acid +   
all-trans-retinol +   
allantoate 
allantoin +   
alliin +   
alliin zwitterion 
allocholic acid +  
allyl octadecyl oxalate 
Aloe C-glucosylchromone 
alpha,alpha-trehalose +   
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-isomethylionyl acetate 
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-melanocyte stimulating hormone  
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-phenylglycine +   
alpha-pinene oxide 
alpha-tocotrienol  
amburoside A 
aminomalonic acid  
ammonioacetone 
ammonium +   
AMN082 dihydrochloride 
anacardic acid 
ananolignan F 
ananolignan L 
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 
anthranilate +  
anthranilic acid +   
anti-inflammatory drug +   
antrocapmphin A 
apelin-12 
apelin-13 
apelin-16(6+) 
apelin-17(6+) 
apo-[acyl-carrier protein] 
aquacob(III)alamin 
arabinitol +  
arachidonate +   
arachidonic acid +   
arachidonoyl-CoA(4-) 
arachidonyl-2'-chloroethylamide  
argon(0) 
aromaticin 
ascidiathiazone A 
ascidiathiazone B 
Asp-Tyr-Met-Gly-Trp-Met-Asp-Phe-NH2 
aspartame  
aspernigrin B 
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 
astilbin  
astragaloside IV  
astressin  
atglistatin 
ATP(3-) 
ATP(4-) +  
auraptene  
AZ3451 
azadiradione +   
AZD2858 
azure B  
b-AP15 
baicalein +   
baicalin  
baricitinib  
bauhinoxepin F 
bauhinoxepin I 
BAY 60-6583  
BAY 73-6691 
BAY11-7085 
beauvericin  
behenate +  
benzothiazine +   
beraprost  
beraprost sodium 
beta-alanine +   
beta-carotene +   
beta-casochemotide-1 
beta-casomorphin-6 (human) 
beta-casomorphin-7 (human) 
beta-casomorphin-7 (human)(1-) 
beta-citrylglutamic acid 
beta-D-fructofuranose 2,6-bisphosphate  
beta-D-fructofuranose 2,6-bisphosphate(4-) 
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->3)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)]-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->3)-beta-D-galactopyranosyl-(1->4)-D-glucopyranose 
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-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc-(1->6)-\{alpha-L-Fucp-(1->4)-[alpha-L-Fucp-(1->2)-beta-D-Galp-(1->3)]-beta-D-GlcppNAc-(1->3)\}-beta-D-Gal-(1->4)-D-Glcp 
beta-D-mannosyldiacetylchitobiosyldiphosphodolichol 
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-lapachone  
beta-leucine +  
beta-myrcene  
betaine aldehyde 
betamethasone phosphate 
betulin +   
betulinic acid +   
bilirubin IXalpha  
bilirubin(2-) 
biliverdin +   
biliverdin hydrochloride 
biliverdin(2-) 
biotin +   
biotin amide 
biotinate +  
biotinyl-5'-AMP 
bis(2-ethylhexyl) phthalate  
bis(2-methyl-3-furyl)disulfide 
bis(2-methyl-4,5-dihydro-3-furyl) disulfide 
bis(2-methylundecan-2-yl) disulfide 
bis(7)-tacrine 
bis(beta-glucosyluronate)bilirubin 
bis-(4-hydroxybenzyl)sulfide 
bixin +   
bongkrekic acid  
bowdichione 
brassicasterol +  
brazilein  
brazilin  
brexanolone 
BRL-50481 
bufalin  
burrodin 
butan-1-ol +   
butrin 
butyl hexanoate 
butyl propionate 
butyrate +   
butyryl-CoA(4-) 
cafestol  
calcidiol +   
calciol +   
calcitetrol 
calcitonin  
calcitriol +   
calcium(2+) +   
camostat  
camostat mesylate 
cannabigerol  
capsiate  
carbamoyl phosphate(2-) 
carbon dioxide  
carbon monoxide  
carboxy-PTIO  
carboxyacetyl-[acyl-carrier protein] 
cardiac glycoside +   
cardiolipin +  
carlinoside 
carnitine +   
carnitinium +  
carnosic acid  
carnosine +   
carpesiolin 
castanospermine 
cauloside D 
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-) 
cenicriviroc 
cerotate +  
CGP-42112A  
CGS-21680  
chenodeoxycholate +  
chenodeoxycholic acid +   
chenodeoxycholoyl-CoA 
chitin  
chloride +   
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-) 
chrysin +   
chrysophanol +   
cilostazol  
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-aconitate(3-) 
cis-dodec-3-enoyl-CoA(4-) 
cis-resveratrol 3-O-glucuronide 
citraconic acid  
citramalate(2-) +  
citramalic acid +  
clarinoside 
cleomiscosin A 
clodronic acid  
clodronic acid disodium salt +  
CMP-N-acetyl-beta-neuraminate(2-) +  
CMP-N-glycoloyl-beta-neuraminate(2-) 
cob(I)alamin 
cob(II)alamin 
cobamamide +   
cocaine(1+) +   
coenzyme A(4-) +  
coenzyme Q10  
columbianadin 
conferol A 
conferol B 
confertin 
coproporphyrin I 
coproporphyrin III 
coproporphyrinogen I 
coproporphyrinogen III(4-) 
CORM 3 
corticosterone +   
cortisol +   
cortisol 21-sulfate 
cortisone +   
coumarin +   
coumestrol +   
crassumolide A 
creatine +   
creatinine  
crotonoyl-CoA(4-) 
cryogenine 
cryptolepine  
CTP(4-) +  
cudraflavone B  
cudratricusxanthone A  
curcumin +   
cyanate +   
cyanidin cation +   
cyclo(L-His-L-Pro) 
cycloheximide  
cyclomontanin A 
cyclomontanin C 
cyclomontanin D 
cyclotetradecane +   
cysteamine +   
cysteaminium 
cystine +   
cystine zwitterion +  
cytidine +   
cytidine 5'-monophosphate +   
cytidine 5'-monophosphate(2-) +  
cytosine +   
D-alaninate 
D-alanine +   
D-alaninium 
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-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-ribose +   
D-ribosylnicotinate 
D-ribulose +  
D-ribulose 5-phosphate(2-) 
D-serine +  
D-tagatofuranose 1,6-bisphosphate(4-) 
D-tagatofuranose 6-phosphate(2-) 
D-threitol  
D-xylulose +   
D-xylulose 5-phosphate(2-) +  
dADP +  
dADP(3-) 
dantrolene  
dATP(4-) 
dCDP 
dCDP(3-) +  
dCTP +   
deamido-NAD(+) +   
debrisoquin +   
decane-1,2-diol 
decanoate +  
decanoic acid +   
decanoyl-[acyl-carrier protein] 
decanoyl-CoA(4-) +  
deguelin  
dehydroascorbide(1-) 
dehydrodiconiferyl alcohol +  
dehydroepiandrosterone +   
dehydroepiandrosterone sulfate  
dehydroepiandrosterone sulfate(1-) +  
Delta(9)-tetrahydrocannabinolic acid  
delta-tocotrienol  
demethoxycurcumin  
demethylzeylasteral 
deoxycholate +  
deoxycholoyl-CoA(4-) 
deoxyhypusine +  
deoxyribonucleic acid +  
desmosterol +   
dGDP(3-) 
dGTP  
diallyl trisulfide  
dibenzo[a,l]pyrene  
diglyceride +   
dihomolinoleate 
dihomolinoleic acid +  
dihydrofolate(2-) 
dihydrogen +   
dihydrolipoamide +   
dihydrolipoate +  
dihydrolipoic acid +   
dihydrolipoylprotein 
dihydrotachysterol 
dihydroxyacetone +   
dihydroxyacetone phosphate  
diinsinin 
diinsininol 
dilazep  
dilazep dihydrochloride 
dimethyloxalylglycine 
dioscin  
diosmetin +   
diosmin  
dioxygen +   
diphosphate(3-) +  
dipsacussaponin A 
disodium clodronate tetrahydrate 
disodium cytidine 5'-monophosphate 
dITP(4-) 
dizocilpine  
dizocilpine maleate  
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+) 
doxercalciferol 
doxycycline +   
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 +  
ebselen  
ecgoninium methyl ester(1+) 
EI-1511-3 
EI-1511-5 
EI-1625-2 
eliprodil  
epi-maslinic acid 
epiandrosterone +  
epiandrosterone sulfate 
epiandrosterone sulfate(1-) 
epicatechin 3-O-(3'-O-methylgallate) 
epidihydrocholesterin 
epitestosterone +   
epoxyazadiradione +  
ergolide 
erucamide  
erythritol +  
erythro-4-hydroxy-L-glutamate(1-) 
erythro-5-hydroxy-L-lysine 
erythro-5-hydroxy-L-lysinium(1+) 
erythronate +  
erythronic acid +  
estetrol 
estra-1(10),4-diene-2,3,17-trione 
estra-1,5(10)-diene-3,4,17-trione 
estradiol +   
estriol +   
estrone +   
estrone 3-O-(beta-D-glucuronide)  
estrone 3-sulfate  
estrone 3-sulfate(1-) 
etazolate  
ethanol +   
ethanolamine +   
ethanolaminium(1+) +  
ethoxide +  
ethoxyquin  
ethyl 2-methylbutyrate 
ethyl cyclohexanecarboxylate 
ethyl linoleate 
ethyl linolenate 
ethyl phenylglyoxylate 
ethyl trans-caffeate  
ethylamine +   
ethylisopropylamiloride  
ethylmalonic acid +   
etidronate disodium 
etidronic acid  
eugenol +   
eupatilin  
eupatorin  
FAD  
FADH2(2-) +  
fangchinoline  
fasudil  
fasudil hydrochloride +  
fasudil hydrochloride hydrate 
felbamate  
ferricytochrome b5 
ferricytochrome c +  
ferrocytochrome c +  
ferroheme b +   
ferrostatin-1 +   
ferulic acid +   
fisetin +   
flavalin A 
flavalin B 
flavokawain B  
floribundasaponin A 
FMN +   
FMN(3-) +  
folic acid +   
formate +  
formyl-CoA(4-) 
fostriecin  
fraxetin +   
fraxin 
fructosylglycine 
fucoidan  
fucoxanthin  
fumarate(2-) +  
galactarate(1-) 
galactarate(2-) 
galactaric acid +   
galactitol +  
galactonic acid +  
galgravin 
gamma-aminobutyrate +   
gamma-aminobutyric acid +   
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-glutamylphenylalanine 
gamma-glutamylthreonine +  
gamma-linolenate +  
gamma-linolenic acid +   
gamma-linolenoyl-CoA(4-) 
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-) 
Genipin  
gentisyl alcohol 
geranyl diphosphate(3-) 
geranyl phosphate 
ghrelin  
gibberellin A1(1-) 
ginkgolide B  
ginsenoside C-K  
ginsenoside F1  
ginsenoside Rb1  
ginsenoside Rb3 
ginsenoside Rd +   
ginsenoside Re  
ginsenoside Rg1  
ginsenoside Rg2  
givinostat 
givinostat hydrochloride +  
givinostat hydrochloride monohydrate 
Glu-Asp-Arg 
Glu-Cys 
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 +  
glycolithocholate 
glycoursodeoxycholic acid  
glycylglycine 
glycylglycine zwitterion 
glyoxylate +  
glyoxylic acid +   
gondamide 
gondoate +  
goralatide  
gordonoside I 
gordonoside J 
gordonoside K 
gordonoside L 
gordonoside M 
gordonoside N 
gordonoside O 
gordonoside P 
gossypin  
gossypol  
grandiflorenic acid 
grasshopper ketone 
graveolide 
GRI977143 
GSK126 
GTP(4-) +  
guanidinoacetic acid 
guanine +   
guanosine 5'-monophosphate(2-) +  
GW405833 
hederagenin 28-O-beta-D-glucopyranoside 
helenalin  
heparan sulfate  
herbacetin  
hexadecan-1-ol +  
hexadecanal +  
hexadecanedioate(2-) 
hexadecanedioic acid +  
hexadecanoate +   
hexan-2-ol 
hexanoate +   
hexanoic acid +   
hexanoyl-CoA +   
hexyl heptanoate 
hinokiflavone  
hispidulin  
histamine +   
histaminium 
holo-[acyl-carrier protein] 
homocysteine zwitterion 
homocystine +  
homocystine zwitterion +  
homogentisate 
homogentisic acid 
homovanillate 
homovanillic acid +   
hordenine 
HU-308  
human blood serum metabolite +   
human urinary metabolite +   
human xenobiotic metabolite +   
huperzine A  
hyaluronic acid  
hydrogen cyanide +   
hydrogencarbonate +   
hydrogensulfite +   
hydrosulfide +  
hydroxidodioxidosulfidosulfate(1-) 
hydroxyacetone +  
hydroxysafflor yellow A  
hyodeoxycholate +  
hyodeoxycholic acid +   
hyperforin  
hypochlorous acid +   
hypotaurine +   
hypothiocyanous acid 
icariin  
icariside II  
icosan-1-ol +  
icosanoate +  
icosanoyl-CoA +  
icosatetraenoic acid +   
IDP(3-) 
iduronic acid +  
Ile(5)-angiotensin II  
Ile(5)-angiotensin II dizwitterion 
Ile-Ile 
ilomastat  
imidazol-4-ylacetate 
imidazole-4-acetaldehyde 
IMP +   
IMP(2-) +  
indicanone 
indirubin  
indirubin-3'-monoxime  
indol-3-ylacetaldehyde  
indole +   
indole-3-acetate 
indole-3-acetic acid +   
indole-3-carboxylic acid +   
indole-5,6-quinone-2-carboxylic acid 
indoxyl sulfate  
inosine +   
interiotherin C 
inuchinenolide B 
inuchinenolide C 
inuviscolide  
iodide +   
iodine atom +   
ipriflavone  
iron(2+) +   
iron(3+) +   
isethionic acid  
isobutrin 
isobutyrate +  
isobutyric acid anhydride 
isobutyryl-CoA +   
isobutyryl-CoA(4-) 
isocaproic acid +   
isocitrate(3-) +  
isoformononetin 
isolimonene 
isolithocholic acid 
isomaltose +  
isonicotinic acid +   
isooctanediol dibutyrate 
isopentenyl diphosphate(3-) 
isopropyl dodecanoate 
isopropyl palmitate  
isorhapontigenin  
isoterpinolene 
isoursodeoxycholic acid 
isovaleryl-CoA(4-) +  
isovaleryl-L-carnitine 
itaconate(2-) 
itaconic acid +  
itaconyl-CoA(5-) 
ITP +  
ITP(3-) 
jaceosidin  
jaspamide  
JQ1 
JTE-013  
JTE-607 dihydrochloride 
JTE-607 free base 
juglanin A 
JWH-133 
kaempferol 3,7-di-O-alpha-L-rhamnoside 
kahweol  
kalopanaxsaponin A 
kalopanaxsaponin B 
kalopanaxsaponin C 
kenpaullone  
keto-phenylpyruvate 
ketone body +   
kinetensin 
kinetensin (1-8) 
kinetensin (1-8)(2+) 
kinetensin(2+) 
kisspeptin-54 
klymollin C 
klymollin D 
klymollin E 
klymollin F 
klymollin G 
klymollin H 
KU-55933 
kurarinol  
kuwanone G  
kynurenate 
kynurenic acid +   
kynurenine +   
L-2-amino-3-oxobutanoic acid 
L-2-aminoadipate(1-) 
L-2-aminoadipic acid +  
L-2-aminopentanoic acid 
L-4-hydroxyglutamic semialdehyde 
L-779976 
L-817818 
L-alloisoleucine +  
L-allysine +  
L-alpha-aminobutyric acid +  
L-arabinitol +  
L-arabinose +  
L-argininium(1+) +  
L-ascorbate +  
L-asparagine +   
L-aspartate(1-) +  
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 +   
lactose +   
lanost-8-ene-3beta,30-diol  
lanosterol +   
lanthionine ketimine 
lapachol  
lasofoxifene  
lauroyl-CoA(4-) +  
Leu-enkephalin  
Leu-Leu 
leucettine L41 
leukotriene A4 +   
leukotriene A4(1-) 
leukotriene B4 +   
leukotriene B4(1-) 
leukotriene B5  
leukotriene C4 +   
leukotriene C4(2-) 
leukotriene D4  
leukotriene E4(1-) 
leukotriene F4 
levoglucosan +  
licofelone  
limonene +   
linoleamide  
lipoamide +   
lipoate +  
lipoxin A4 +   
lipoxin B4 +  
lipoyl-AMP(1-) +  
lipoylprotein 
liproxstatin-1  
liquiritin  
liraglutide  
lithocholate +  
lithocholic acid +   
lithocholyl-CoA 
lixisenatide  
loganin +   
lugdunin 
lupulin A 
luteolin +   
LY 117018  
LY 379268  
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 
macabarterin 
madecassoside  
magnoshinin 
mallotophilippen A 
mallotophilippen B 
mallotophilippen C 
mallotophilippen D 
malonate(2-) +  
malonic acid +   
malonyl-CoA(5-) 
maltose +   
mangicol A 
mangiferin  
mannarate(2-) +  
mannaric acid +  
mannioside A 
mannitol +   
maslinic acid +   
maysin 
MCC950 
medronic acid 
melatonin +   
meldonium  
melittin  
memantine  
memantine hydrochloride 
menaquinone-4 +   
menaquinone-7  
menaquinone-8 
mesaconate(2-) 
mesaconic acid +  
mesaconyl-CoA 
meso-2,6-diaminopimelic acid +  
meso-2,6-diaminopimelic acid dizwitterion 
meso-3,3'-didemethoxynectandrin B 
meso-zeaxanthin 
Met-enkephalin 
metamizole 
metamizole sodium  
methacrylyl-CoA  
methanethiol +   
methanol +   
methanol extract of Sorbus alnifolia 
methionine S-oxide +  
methoxide 
methyl 3,4,5-trihydroxybenzoate  
methyl 3,4-dihydroxybenzoate 
methyl 3-phenylpropanoate 
methyl 4,23,29-trihydroxy-3,4-seco-olean-12-en-3-oate-28-oic acid 
methyl cinnamate +  
methyl cyclohexanecarboxylate 
methyl icosapentaenoate 
methyl phenylglyoxalate 
methylammonium +  
methylcobalamin  
methylcyclohexane 
methylcyclopentane 
methylene blue  
methylene group 
methylglyoxal +   
methylmalonate(1-) 
methylmalonate(2-) 
methylmalonic acid +   
methylmalonyl-CoA +  
methylparaben  
methylprednisolone suleptanate 
methylsuccinic acid 
michigazone 
midafotel 
miltefosine  
minabeolide 1 
minabeolide 2 
minabeolide 4 
minabeolide 5 
minabeolide 8 
MLN-4760 
mocetinostat  
molsidomine  
monascorubrin 
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-) 
monotropein  
morin  
multifidol glucoside 
murideoxycholate 
murideoxycholic 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(12-) 
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)-(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)-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(5)-ethyl-L-glutamine  
N(6),N(6),N(6)-trimethyl-L-lysine +  
N(6)-(1,2-dicarboxylatoethyl)-AMP(4-) 
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'-bis(diphenylmethyl)ethane-1,2-diamine 
N,N'-diacetylchitobiose +  
N,N'-diacetylchitobiosyldiphosphodolichol 
N,N-dimethylacetamide  
N,N-dimethylethanolamine phosphate 
N,N-dimethylglycine  
N-(15Z-tetracosenoyl)ethanolamine 
N-(2-furoyl)glycinate 
N-(2-furoyl)glycine 
N-(2-methylbutanoyl)glycine 
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-[(S)-lactoyl]-L-phenylalanine 
N-[2-(4-phenoxybenzyl)benzimidazol-5-yl]methanesulfonamide 
N-\{2-[(4-benzylpiperidin-1-yl)methyl]benzimidazol-5-yl\}methanesulfonamide 
N-acetyl-alpha-D-glucosamine 1-phosphate 
N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->4)-D-glucose +  
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-acetylneuraminlactose sulfate 
N-acetylputrescinium 
N-acetylserotonin  
N-acyl-beta-D-galactosylsphingosine +  
N-acylsphinganine +   
N-acylsphingosine +   
N-acylsphingosine 1-phosphate(2-) +  
N-arachidonoyl-2-oxoserotonin 
N-arachidonoyl-L-serine 
N-arachidonoylglycinate 
N-arachidonoylserotonin 
N-benzoylglycinate 
N-benzylhexadecanamide 
n-butyl oleate 
N-butylformamide 
N-carbamoyl-beta-alaninate 
N-carbamoyl-L-aspartate(2-) 
N-carbamoylaspartic acid +  
N-carbamoylglutamic acid 
N-docosanoyltaurine 
N-formimidoyl-L-glutamate(2-) +  
N-formyl-L-kynurenine +  
N-formylanthranilate 
N-glycoloylneuraminate +  
N-hexacosahexaenoylsphingosine 
N-hexadecanoylglycine +  
N-hexadecanoylsphinganine-1-phosphocholine 
N-methyl-1-deoxynojirimycin 
N-methylbutan-2-amine 
N-methylethanolaminium phosphate(1-) 
N-methylnorsalsolinol 
N-methylphenylethanolamine 
N-methylphenylethanolaminium 
N-methylproline 
N-methylproline zwitterion 
N-methylputrescinium(2+) 
N-methylserotonin 
N-methyltyraminium 
N-octadecanoylglycine 
N-oleoyl-L-serine 
N-palmitoyl-S-[2,3-bis(palmitoyloxy)propyl]-Cys-Ser-Lys-Lys-Lys-Lys  
N-phosphocreatinate(2-) 
N-phosphocreatine  
N-propylbenzamide 
N-ribosylnicotinamide  
N-tert-butyl(3,5,6-trimethylpyrazin-2-yl)methanimine N-oxide 
NAD(1-) +  
NADH(2-) +  
NADP(3-) 
NADPH(4-) +  
nandrolone +   
naphthalene +   
naringin  
narirutin 
necrosulfonamide 
neocasomorphin 
neophytadiene 
neosaxitoxin  
neriifolin +  
nerolidol +   
neurotensin  
neurotensin (1-12) 
neurotensin (1-12)(1+) 
neurotensin (1-7) 
neurotensin (1-8) 
neurotensin(1+) 
nicotinamide +   
nicotinate D-ribonucleotide(2-) 
nifedipine  
ninhydrin  
nitric oxide  
nitrite +   
NMN(-) 
NNC 55-0396 (free base) +  
NNC 55-0396 dihydrochloride 
nociceptin  
nomilin  
nonanal +   
nordazepam  
norgestrel  
norlaudanosoline +   
norsalsolinol +  
notoginsenoside R1  
O(4')-sulfo-L-tyrosinate(1-) 
O(4')-sulfo-L-tyrosine 
O(4)-methylthymine 
O-(2-tetradecenoyl)carnitine 
O-(3-hydroxyvaleryl)-L-carnitine 
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-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 
ochnaflavone 
octadecadienoate +  
octadecan-1-ol +   
octadecanoate +  
octadecanoic acid +   
octan-3-ol 
octanoate +  
octanoic acid +   
octanoyl-[acyl-carrier protein] 
octanoyl-CoA(4-) +  
oleamide  
oleocanthal 
oleoyl-CoA(4-) 
oleuropein +   
oleuropein aglycone 
omaveloxolone  
ombuin 
omega-3 fatty acid +   
omega-hydroxymenaquinone-4 
omeprazole +   
Ophthalmate 
ophthalmic acid 
ornithine +   
ornithinium(1+) +  
orobol +  
orotate +  
orotidine 5'-phosphate 
orotidine 5'-phosphate(3-) 
ospemifene  
oxalate(1-) +  
oxalate(2-) +   
oxalic acid +   
oxaloacetate(2-) 
oxatomide  
oxidopamine  
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 
p-menthan-1-ol 
paclitaxel +   
pacritinib 
paliperidone 
paliperidone palmitate  
palmitoleamide 
palmitoleate +  
palmitoleoyl ethanolamide 
palmitoleoyl-CoA(4-) +  
palmitoyl ethanolamide  
palmitoyl-[acyl-carrier protein] 
palmitoyl-CoA(4-) 
pantetheine 
pantetheine 4'-phosphate(2-) +  
parabanic acid +  
pectolinarin 
pentamidine  
pentan-1-ol +   
pentan-3-amine 
peptide YY 
perillic acid +   
perillyl aldehyde  
peroxynitrite 
PH 797804 
phenethyl caffeate  
phenylacetaldehyde +   
phenylacetate +  
phenylacetic acid +   
phenylacetyl-CoA(4-) +  
phenylacetylglycine +   
phenylacetylglycine(1-) 
phenylethanolamine +  
phenylethanolaminium 
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 
phosphocholine +   
phosphoenolpyruvate  
phosphoric acid +   
phylloquinone  
physcion +   
phytanate +  
phytanoyl-CoA(4-) 
piclamilast  
picolinic acid +   
picrinine +  
pinellic acid 
pinocembrin +   
pioglitazone +   
pipecolate +  
piperidine +   
piperlactam S 
PJ34  
PJ34 hydrochloride 
PMX-205 
poly(N-acetyllactosamine)  
porphobilinogen(1-) 
potassium 2-(4-carboxylatophenyl)-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide 
potassium(1+) +   
PR-39  
praliciguat 
prednisolone phosphate 
prednisolone sodium phosphate 
pregnenolone +   
pregnenolone sulfate  
prenyl diphosphate(3-) 
presqualene diphosphate(3-) 
preuroporphyrinogen(8-) 
previtamin D3 
pristanal 
pristanic acid +  
pristanoyl-CoA +  
Pro-Hyp 
Pro-Hyp zwitterion 
procyanidin B1 +   
procyanidin B3 +   
procyanidin C1 
progesterone +   
proline +   
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 +   
protectin D1 +  
protirelin 
protoporphyrinate 
protoporphyrinogen(2-) 
prunetin +   
psychosine +  
psychosine sulfate 
psychosine(1+) 
pterolinus A 
pterolinus B 
pterolinus D 
pterostilbene  
puerarin +   
pyridoxal +   
pyridoxal 5'-phosphate +   
pyridoxal 5'-phosphate(2-) 
pyridoxal hydrochloride 
pyridoxamine +   
pyridoxamine 5'-phosphate 
pyridoxamine 5'-phosphate(1-) 
pyridoxamine dihydrochloride 
pyridoxamine hydrochloride 
pyridoxaminium(1+) +  
pyridoxine +   
pyridoxine 5'-phosphate(2-) 
pyroglutamylglutaminate 
pyroglutamylglutamine 
pyrrolidine dithiocarbamate  
pyrroloquinoline quinone  
quercetin 3,4'-di-O-beta-D-glucoside 
quercetin 3-O-beta-D-glucopyranoside  
quillaic acid +  
quinaldate 
quinaldic acid 
quinolinate(1-) +  
quinolinate(2-) 
quinoline-4,6-diol 
quinoline-4,8-diol 
quinolinic acid  
quisinostat 
rac-1-monolinoleoylglycerol 
rac-lisofylline 
raloxifene  
raloxifene hydrochloride 
ramipril  
ramiprilat  
rasagiline  
rataniaphenol I 
rataniaphenol II 
rataniaphenol III 
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 
RepSox 
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 
retinal +   
retinoic acid +   
retinol +   
RGFP966  
rhamnetin 
rhapontigenin +   
ribitol +   
riboflavin +   
ribothymidine +  
ricolinostat  
rifampicin +   
rivastigmine  
rivastigmine tartrate 
Ro 25-6981  
Ro 25-6981 maleate 
rohitukine 
rosuvastatin  
rosuvastatin calcium  
Ru360 
rubimaillin  
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-formylglutathionate(1-) 
S-formylglutathione 
S-methyl-5-thio-alpha-D-ribose 1-phosphate(2-) 
S-methyl-5-thio-D-ribulose 1-phosphate(2-) 
S-methyl-L-thiocitrulline  
S-sulfo-L-cysteine 
SAICAR(4-) 
salvianolic acid B  
salvigenin  
sappanchalcone  
sapropterin +   
sarcosinate 
sarcosine +  
sarcosinium 
savinin 
SB 203580  
SB 415286  
SB220025 
SB225002 
scalaradial  
SCH-79797 
sciadopitysin  
scoparone  
scyllo-inositol +   
Se-methylselenocysteine +   
sebacate(2-) 
sebacic acid +   
sedoheptulose 1,7-bisphosphate(4-) 
sedoheptulose 7-phosphate 
sedoheptulose 7-phosphate(2-) 
selenate +   
selenide +   
selenocysteine +   
selenophosphate 
selinexor  
semaglutide  
serotonin +   
serotonin(1+) 
sieboldianoside A 
sigmoidin A 
sigmoidin B 
sirtinol  
skatole  
SL-327  
sn-glycerol 3-phosphate 
sn-glycerol 3-phosphate(2-) 
SN50 
sodium 3-hydroxybutyrate 
sodium ascorbate 
sodium aurothiomalate  
sodium dehydroepiandrosterone sulfate 
sodium ferulate 
sodium glycochenodeoxycholate 
sodium glycodeoxycholate 
sodium glyoxylate 
sodium hexanoate 
sodium orotate 
sodium phenylbutyrate 
sodium(1+) +   
sotagliflozin 
specialised pro-resolving mediator +   
spermidine(3+) +  
spermine(4+) +  
sphinganine +   
sphinganine 1-phosphate(1-) 
sphinganine(1+) +  
sphingomyelin d18:1(1+) 
sphingosine +   
sphingosine 1-phosphate(1-) 
sphingosine(1+) +  
squalene +   
stearoyl-CoA(4-) 
stevioside +   
SU4312 
suberic acid +   
succinate(2-) +  
succinyl-CoA(5-) 
sucrose +   
sulfate +   
Sulfo((4R)-4-((3R,5S,7R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoyl)alanine 
sulfoglycolithocholate(2-) 
sunitinib +   
superoxide  
suramin  
suramin sodium 
swertisin 
syringin  
tachysterol 3 
tagatose 6-phosphate +  
TAK-733 
talosin A 
taltirelin +  
tamoxifen +   
taraxasterol  
taurallocholic acid 
taurine +   
tauro-alpha-muricholic acid 
tauro-beta-muricholate 
tauro-beta-muricholic acid  
tauro-omega-muricholic acid 
taurochenodeoxycholate +  
taurochenodeoxycholic acid +   
Taurochenodeoxycholic acid 3-sulfate 
Taurochenodeoxycholic acid 7-sulfate 
taurocholate +   
Taurocholenate sulfate 
taurocholic acid  
Taurocholic acid 3-sulfate 
Taurocholic acid sodium salt hydrate 
Taurocholic Acid-D4 
Taurodehydrocholic acid 
taurodeoxycholate 
taurodeoxycholic acid +   
taurohyodeoxycholic acid  
taurolidine +  
taurolithocholate 
taurolithocholic acid +   
Taurolithocholic acid 3-glucuronide 
taurolithocholic acid sulfate  
taurolithocholic acid sulfate(2-) 
Tauromurocholate 
tauroursocholate 
tauroursocholic acid 
tauroursodeoxycholic acid  
A bile acid taurine conjugate derived from ursoodeoxycholic acid.
TDZD-8 
tectorigenin +   
tenocyclidine 
tepoxalin  
teprenone  
testosterone +   
testosterone 17-glucosiduronic acid  
testosterone acetate 
tetracosanoate +  
tetracosanoic acid +   
tetracosanoyl-CoA 
tetradecan-2-ol 
tetradecanedioate(2-) 
tetradecanedioic acid +  
tetradecanoate +  
tetradecanoic acid +   
tetragastrin 
tetrahydroxycurcumin 
tetramethylpyrazine  
tetratetracontane 
theasinensin A 
theophylline +   
thiamine(1+) +   
thiamine(1+) diphosphate(1-) 
thiamine(1+) monophosphate +  
thiamine(1+) monophosphate(2-) 
thiamine(1+) triphosphate 
thiamine(1+) triphosphate(4-) 
thiocyanate +   
thioredoxin disulfide 
thioredoxin dithiol 
thiosulfate(2-) +   
thromboxane A2(1-) +  
thromboxane B2 +   
thromboxane B3 
thymidine +   
thymine +   
thymoquinone  
tibolone  
tideglusib  
tilorone  
tilorone dihydrochloride 
tiratricol  
tolbutamide  
toluquinol  
tolypodiol 
toremifene  
trabectedin  
trans-1,2-dithiane-4,5-diol +  
trans-13-docosenamide 
trans-2-decenoic acid +  
trans-2-octadecenoyl-CoA 
trans-3-methylglutaconyl-CoA(5-) 
trans-4-hydroxy-L-proline +  
trans-caffeate +  
trans-dec-2-enoyl-CoA(4-) 
trans-dodec-2-enoyl-CoA(4-) 
trans-ferulic acid +   
trans-hex-2-enoyl-CoA 
trans-oct-2-enoyl-CoA 
trans-rhaponticin +   
trans-tetradec-2-enoyl-CoA(4-) 
trans-urocanate 
trans-urocanic acid  
trans-vaccenate(1-) 
triacsin C  
triacylglycerol 50:6 +  
triacylglycerol 60:14 +  
triacylglycerol 62:15 +  
triapine  
trichloro(docosyl)silane 
tricosanoic acid +  
tridecan-1-ol 
tridecanal 
triethylene glycol monomethyl ether 
trilobatin  
trimethylenediamine +   
trimethylenediaminium 
triphosphate(5-) +  
triptonide  
triptriolide 
trofinetide 
Trolox 
tropisetron  
tropisetron hydrochloride 
tryptamine +   
tryptaminium +  
tyramine +   
tyraminium 
tyrphostin B42  
U69593  
ubiquinone-0  
ubiquinone-9  
UDP(3-) 
UDP-alpha-D-glucuronate(3-) 
UDP-alpha-D-glucuronic acid +   
UDP-alpha-D-xylose(2-) 
UDP-D-galactose +   
UDP-D-galactose(2-) +  
UDP-D-glucose(2-) +  
UDP-N-acetyl-alpha-D-galactosamine  
UDP-N-acetyl-alpha-D-glucosamine(2-) 
UDP-N-acetyl-D-galactosamine(2-) +  
undecanoate 
undecanoic acid +   
uracil +   
urate anion +  
urea +   
uric acid +   
uridine +   
uridine 5'-monophosphate +   
uridine 5'-monophosphate(2-) +  
uridine triacetate 
urobilinogen 
urocanate +  
urocanic acid +   
uroporphyrin I 
uroporphyrin III 
uroporphyrinogen I 
uroporphyrinogen III(8-) 
ursodeoxycholate 
ursodeoxycholic acid +   
ursodeoxycholoyl-CoA 
UTP(4-) +  
valproic acid +   
vanillin +   
vanillylmandelate 
vanillylmandelic acid  
velutin 
vestitol +  
vinyl benzoate 
viridiflorol 
visnagin 
vitamin D2 +   
W54011 
water +   
WIN 55212-2  
xanthogalenol 
xanthosine  
XMU-MP-1  
xuezhikang 
xylitol +   
xyloketal B 
Yosprala 
Z-DEVD-FMK 
Z-Val-Ala-Asp(OMe)-CH2F 
Z-Val-Phe-H  
zerumbone +   
zhankuic acid A +  
zinc(2+) +   
zingerone  
zofenopril 
zofenopril calcium 
zofenoprilat 
zofenoprilat arginine 
zoledronic acid  
zymosterol +   
zymosterol intermediate 2 

Synonyms
Exact Synonyms: 2-[(3alpha,7beta-dihydroxy-24-oxo-5beta-cholan-24-yl)amino]ethanesulfonic acid
Related Synonyms: 2-(((3-alpha,5-beta,7-beta)-3,7-Dihydroxy-24-oxocholan-24-yl) amino)ethanesulfonic acid ;   2-{[(3alpha,5beta,7beta)-3,7-dihydroxy-24-oxocholan-24-yl]amino}ethane-1-sulfonic acid ;   3alpha,7beta-dihydroxy-5beta-cholanoyltaurine ;   Formula=C26H45NO6S ;   InChI=1S/C26H45NO6S/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-/m1/s1 ;   InChIKey=BHTRKEVKTKCXOH-LBSADWJPSA-N ;   N-(3-alpha,7-beta-Dihydroxy-5-beta-cholan-24-oyl)-Taurine ;   N-(3alpha,7beta-dihydroxy-5beta-cholan-24-oyl)taurine ;   N-ursodeoxycholoyltaurine ;   SMILES=C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@H](C[C@@]2(C[C@@H](C1)O)[H])O)[H])(CC[C@]4([H])[C@@H](CCC(NCCS(O)(=O)=O)=O)C)[H])C)[H])C
Alternate IDs: CHEBI:132326
Xrefs: CAS:14605-22-2 ;   HMDB:HMDB0000874 ;   KEGG:C16868 ;   LIPID_MAPS_instance:LMST05040015
Xref Mesh: MESH:C031655
Xrefs: MetaCyc:CPD-18799 ;   PDBeChem:5D5 ;   PMID:25664595 ;   PMID:26282527 ;   PMID:26427442 ;   PMID:26499839 ;   PMID:26541419 ;   PMID:26748055 ;   PMID:26759227 ;   PMID:26765262
Cyclic Relationships: is_conjugate_acid_of CHEBI:132028

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