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Term:
decarbamoylsaxitoxin (CHEBI:133919)
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Parent Terms Term With Siblings Child Terms
alkaloid +     
guanidines +     
ketone hydrate +     
neurotoxin +   
primary alcohol +     
pyrrolopurine +     
toxin +   
xenobiotic +   
(+)-(2S,3R,9R)-pristinol 
(+)-(7'S,8S,8'S)-3',4-dihydroxy-2',3,4',5-tetramethoxy-6',9-epoxy-2,7'-cyclolignan-9'-ol 
(+)-(7R,7'R,7''R,7'''S,8S,8'S,8''S,8'''S)-4'',4'''-dihydroxy-3,3',3'',3''',5,5'-hexamethoxy-7,9':7',9-diepoxy-4,8'':4',8'''-bisoxy-8,8'-dineolignan-7'',7''',9'',9'''-tetraol 
(+)-(7R,7'R,7''S,7'''S,8S,8'S,8''S,8'''S)-4'',4'''-dihydroxy-3,3',3'',3''',5,5'-hexamethoxy-7,9':7',9-diepoxy-4,8'':4',8'''-bisoxy-8,8'-dineolignan-7'',7''',9'',9'''-tetraol 
(+)-(7R,7'R,8S,8'S)-4'-hydroxy-3,3',4,5,5'-pentamethoxy-7,7'-epoxylignan-9,9'-diol 
(+)-(7S,8R,8'R)-5,5'-dimethoxylariciresinol 
(+)-(7S,8S)-1',4-dihydroxy-3,3',5'-trimethoxy-7',8',9'-trinor-8,4'-oxyneolignan-7,9-diol 
(+)-(7S,8S)-4-hydroxy-3,3',5'-trimethoxy-8',9'-dinor-8,4'-oxyneolignan-7,9-diol-7'-oic acid 
(+)-aplysinillin 
(+)-caryolan-1-ol 
(+)-copalol 
(+)-isoafricanol 
(+)-isolariciresinol 
(+)-jasplakinolide V 
(+)-jasplakinolide W 
(+)-jasplakinolide Z1 
(+)-jasplakinolide Z2 
(+)-jasplakinolide Z3 
(+)-jasplakinolide Z5 
(+)-lariciresinol +   
(+)-lyoniresinol +  
(+)-lyoniresinol 4,4'-bis-O-beta-D-glucopyranoside 
(+)-lyoniresinol-3-alpha-O-beta-D-glucopyranoside 
(+)-O-methylkolavelool 
(+/-)-gamma-Lycorane 
(-)-(7''R,8''S)-4'',5,7-trihydroxy-3',5'-dimethoxy-4',8''-oxyflavonolignan-7'',9''-diol 
(-)-(7''S,8''S)-4'',5,7-trihydroxy-3',3'',5'-trimethoxy-4',8''-oxyflavonolignan-7'',9''-diol 
(-)-(7''S,8''S)-4'',5,7-trihydroxy-3',5'-dimethoxy-4',8''-oxyflavonolignan-7'',9''-diol 
(-)-(7'S,8S,8'R)-4,4'-dihydroxy-3,3',5,5'-tetramethoxy-7',9-epoxylignan-9'-ol-7-one 
(-)-(7R,7'R,7''R,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5,5',5''-hexamethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,7'R,7''R,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5,5'-pentamethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,7'R,7''R,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5-tetramethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,7'R,7''S,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5,5',5''-hexamethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,7'R,7''S,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5,5'-pentamethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,7'R,7''S,8S,8'S,8''S)-4',4''-dihydroxy-3,3',3'',5-tetramethoxy-7,9':7',9-diepoxy-4,8''-oxy-8,8'-sesquineolignan-7'',9''-diol 
(-)-(7R,8S,7''S,8''R)-3,3'',5,5'-tetramethoxy-4''-hydroxy-4',7-epoxy-8',9'-dinor-4,8''-oxy-8,3'-sesquineolignan-7'',9,9''-triol-7'-al 
(-)-(7R,8S,7'E)-3,4,5,5'-tetramethoxy-4',7-epoxy-8,3'-neolign-7'-ene-9,9'-diol 
(-)-Alstolucine A, (rel)- 
(-)-Alstolucine B, (rel)- 
(-)-Alstolucine C 
(-)-Alstolucine D, (rel)- 
(-)-Alstolucine E 
(-)-Alstolucine F 
(-)-anisomycin  
(-)-antofine  
(-)-Apparicine 
(-)-chuangxinmycin 
(-)-demecolcine  
(-)-dibromophakellin 
(-)-duryne 
(-)-duryne B 
(-)-duryne C 
(-)-duryne D 
(-)-duryne E 
(-)-duryne F 
(-)-ent-copalol 
(-)-ephedrine  
(-)-jasplakinolide Z4 
(-)-marinopyrrole A 
(-)-marinopyrrole B 
(-)-Ormosanine 
(-)-Quebrachamine 
(-)-Tau-muurolol 
(11Z)-icos-11-en-1-ol 
(13E)-labda-7,13-dien-15-ol 
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylic acid 
(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1-carboxylic acid 
(1R,5aS,6R)-1,4,5,5a,6,9-hexahydrophenazine-1,6-dicarboxylic acid 
(1S,15S,18S,19S,20S)-N-[2-(4-aminophenyl)ethyl]-18-hydroxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxamide 
(2'S)-Hydroxy-(11S,12R)-dihydrostemofoline, (rel)- 
(2'S)-Hydroxystemofoline 
(2->6)-beta-D-fructan 
(20R)-28-hydroxylupen-30-al-3-one 
(2E)-3-(4-\{[3-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-(sulfooxy)propan-2-yl]oxy\}-3-methoxyphenyl)prop-2-enoic acid 
(2E)-3-[4-(\{1,3-dihydroxy-1-[3-methoxy-4-(sulfooxy)phenyl]propan-2-yl\}oxy)-3-methoxyphenyl]prop-2-enoic acid 
(2E,6E,10E)-omega-hydroxyfarnesyl diphosphate 
(2R)-2-[(1R)-1-hydroxy-12-\{2-[14-(2-icosylcyclopropyl)tetradecyl]cyclopropyl\}dodecyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-12-\{2-[14-(2-icosylcyclopropyl)tetradecyl]cyclopropyl\}dodecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-14-\{2-[14-(2-icosylcyclopropyl)tetradecyl]cyclopropyl\}tetradecyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-14-\{2-[14-(2-icosylcyclopropyl)tetradecyl]cyclopropyl\}tetradecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-16-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}hexadecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-icosylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-icosylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-nonadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-nonadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]tetracosanoate 
(2R)-2-[(1R)-1-hydroxy-18-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}octadecyl]tetracosanoic acid 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-icosylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-icosylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-nonadecylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-nonadecylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}icosyl]hexacosanoic acid 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}icosyl]tetracosanoate 
(2R)-2-[(1R)-1-hydroxy-20-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}icosyl]tetracosanoic acid 
(2R)-2-[(1R)-1-hydroxy-22-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}docosyl]hexacosanoate 
(2R)-2-[(1R)-1-hydroxy-22-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}docosyl]hexacosanoic acid 
(2R)-2-[(1R)-14-\{2-[(15Z)-hexatriacont-15-en-1-yl]cyclopropyl\}-1-hydroxytetradecyl]hexacosanoate 
(2R)-2-[(1R)-14-\{2-[(15Z)-hexatriacont-15-en-1-yl]cyclopropyl\}-1-hydroxytetradecyl]hexacosanoic acid 
(2R)-2-\{(1R)-1-hydroxy-15-[2-(20-methoxy-21-methylnonatriacontyl)cyclopropyl]pentadecyl\}hexacosanoic acid +  
(2R)-2-carbamimidamido-2-cyclohexyl-N-(2-\{4-[3-(2,3-dichlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl\}-2-oxoethyl)acetamide 
(2R,3S)-dihydrodehydrodiconiferyl alcohol 
(2R,3S,11bR)-2-[[(1S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine 
(2R,4S)-2-methyltetrahydrofuran-2,3,3,4-tetrol 
(2R,5Z)-4-methyl-5-[2-(phosphonooxy)ethylidene]-2,5-dihydro-1,3-thiazole-2-carboxylic acid 
(2S)-3-(7-carbamimidoylnaphthalen-2-yl)-2-[4-(\{1-[(1E)-ethanimidoyl]piperidin-4-yl\}oxy)phenyl]propanoic acid 
(2S)-amino[(4R)-2-iminohexahydropyrimidin-4-yl]acetic acid 
(2S,3R)-2-[(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine 
(2S,3R)-2-[[(1R)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]methyl]-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine 
(2S,3R)-capreomycidine 
(2S,3R)-dihydrodehydrodiconiferyl alcohol 
(2S,3S)-2,3-dihydro-3-hydroxymethyl-2-(4-hydroxyphenyl)-5-(E)-propenylbenzofuran 
(2S,4R)-1-acetyl-N-[(1S)-4-[(aminoiminomethyl)amino]-1-(benzothiazol-2-ylcarbonyl)butyl]-4-hydroxypyrrolidine-2-carboxamide 
(2Z,10Z)-3-hydroxy-5,17-dioxo-4,5-secoestra-2,10-diene-3-oate 
(2Z,10Z)-3-hydroxy-5,17-dioxo-4,5-secoestra-2,10-diene-3-oic acid 
(2Z,4Z)-2,3-dichloromuconic acid 
(3,4-dimethoxyphenyl)methanol +  
(3E)-3,4-didehydrorhodopin 
(3E)-3-[(1R,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-ylidene]pyruvate 
(3E)-3-[(1R,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-ylidene]pyruvic acid 
(3R,4R)-3-[(1S)-1-hydroxyalkyl]-4-(hydroxymethyl)oxolan-2-one 
(3R,4R)-3-acyl-4-(hydroxymethyl)oxolan-2-one 
(3R,6R,8aS)-6-[(benzylsulfonyl)amino]-N-(3-carbamimidamidopropyl)-5-oxohexahydro-5H-[1,3]thiazolo[3,2-a]pyridine-3-carboxamide 
(3S)-3-hydroxy-L-arginine 
(3Z,6Z,9Z)-dodecatrienol 
(4-\{4-[2-(gamma-L-glutamylamino)ethyl]phenoxymethyl\}furan-2-yl)methanamine 
(4aR,5aS,8aR,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one 
(4aR,8aR,15bR)-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinoline-14-one 
(4R,5S,6S,7R)-4,7-dibenzyl-5,6-dihydroxy-1,3-bis[4-(hydroxymethyl)benzyl]-1,3-diazepan-2-ylidenecyanamide 
(4R,6R)-hydroxy-2,2,6-trimethylcyclohexanone 
(4S)-4,16-dihydroxyretinoic acid 
(5aS)-5,5a-dihydrophenazine-1,6-dicarboxylic acid 
(6S)-6-methyloctan-1-ol 
(6S,8aS)-2-(benzylsulfonyl)-N-\{[1-(N'-hydroxycarbamimidoyl)piperidin-4-yl]methyl\}-4-oxooctahydropyrrolo[1,2-a]pyrazine-6-carboxamide 
(7S)-7-acetamido-1,2,3-trimethoxy-6,7-dihydro-5H-dibenzo[5,3-b:1',2'-e][7]annulene-9-carboxylic acid 
(7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine 
(9Z,11Z,13E,15E)-4-oxooctadecatetraenoic acid 
(E)-1-hydroxy-2-(non-1-en-1-yl)quinolin-4-one 
(E)-3-decen-1-ol 
(E)-N-(3-hydroxy-1-oxocyclopent-2-en-2-yl)-3-(4-hydroxy-3-methoxyphenyl) propenamide 
(E)-roxithromycin  
(E,E)-2-methyl-6-oxohepta-2,4-dienol 
(N(omega)-L-arginino)succinic acid  
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetate 
(R)-(2-chloro-5-oxo-2,5-dihydro-2-furyl)acetic acid 
(R)-12-hydroxysqualene 
(R)-3-(indol-3-yl)-2-oxobutyric acid 
(R)-3-phosphomevalonic acid 
(R)-5-phosphomevalonic acid 
(R)-cembrene A 
(R)-DRF053 +  
(R)-isodihydrodehydrodiconiferyl alcohol 
(R)-nephthenol 
(R)-sarin +   
(R)-tetrahydrodehydrodiconiferyl alcohol 
(R,S)-Scoulerine 
(S)-1-hydroxy-N-methylcanadine 
(S)-2-aminopropan-1-ol +  
(S)-2-chloropropanoic acid 
(S)-4,5-dihydroxy-2-oxopentanal 
(S)-6-acetamido-3-aminohexanoic acid 
(S)-amphetamine +   
(S)-colchicine  
(S)-gabaculine +  
(S)-isodihydrodehydrodiconiferyl alcohol 
(S)-nicotine +   
(S)-sarin +   
(S)-tetrahydrodehydrodiconiferyl alcohol 
(Z)-4-methoxy-2,2-bipyridine-6-carbaldehyde oxime 
(Z)-hex-3-en-1-ol +   
1',2'-didehydrostemofoline 
1'-hydroxy-gamma-carotene 
1'-hydroxytorulene 
1,1'-dihydroxy-3,4-didehydrolycopene 
1,1-diunsubstituted alkanesulfonate +   
1,2,3-trimethylbenzene +  
1,2,4-trimethylbenzene +   
1,2,5,6,9,10-hexabromocyclododecane 
1,2-dehydrogeissoschizoline 
1,2-dibromoethane  
1,2-dibutyrin  
1,2-dinitroglycerol 
1,2-O-Diacetylzephyranthine 
1,3-dinitrobenzene  
1,3-diphenylguanidine +  
1,4-diguanidinobutane 
1-(3,4-dimethoxyphenyl)ethane-1,2-diol 
1-(3-(trifluoromethyl)phenyl)piperazine  
1-(3-chlorophenyl)piperazine  
1-(4-\{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy\}-3,5-dimethoxyphenyl)propane-1,2,3-triol 
1-(4-carboxy-2-guanidinophenyl)-5,5-bis(hydroxymethyl)pyrrolidin-2-one 
1-(4-tert-butylcarbamoylpiperazin-1-ylcarbonyl)-3-(3-guanidinopropyl)-4-oxoazetidine-2-carboxylic acid 
1-(alpha-D-glucosyl)-3-keto-(1,27R)-octacosanediol 
1-(alpha-D-mannosyl)-3-keto-(1,27R)-octacosanediol 
1-(beta-D-xylopyranosyl)cytosine 
1-(methylthio)ribulose 5-phosphate 
1-(methylthio)ribulose 5-phosphate(2-) 
1-[(1S,2S,4S,5R)-4-hydroxy-5-(hydroxymethyl)bicyclo[3.1.0]hexan-2-yl]thymine 
1-[(1S,3S,4R,5S)-3-hydroxy-4-(hydroxymethyl)bicyclo[3.1.0]hexan-1-yl]thymine 
1-[(2-hydroxyethoxy)methyl]-6-(phenylsulfanyl)thymine 
1-[4-carboxy-2-(3-pentylamino)phenyl]-5,5-bis(hydroxymethyl)pyrrolidin-2-one 
1-benzylpiperazine  
1-bromopropane  
1-dodecylguanidine 
1-guanidino-1-deoxy-scyllo-inositol 
1-heptanol  
1-hydroxy-5-phenyl-3-pentanone 
1-hydroxyprotostemonine, (rel)- 
1-methyl-4-phenyl-1,2,3,6-tetrahydropyridine +   
1-naphthyl tetradecanoate 
1-O-Acetyllycorine 
1-tuberculosinyladenosine(1+) 
10-deoxysarpagine 
10-undecen-1-ol 
11,20-dihydroxyferruginol +  
11,20-dihydroxysugiol 
11-Hydroxyvittatine 
11-Methoxysampangine 
11beta,13-dihydro-8-deoxylactucin 
11beta,13-dihydrolactucin 
11beta,13-dihydrolactucopicrin 
11beta-hydroxytestosterone 
12,18-didecarboxysirohaem 
12-aminododecanoic acid 
12-deoxynogalonic acid 
12-deoxyphorbol-13-(3E,5E-decadienoate) 
12-epi-fischerindole G 
12-epi-fischerindole U 
12-epi-hapalindole U 
12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide d 
12-ethyl-8-isobutyl-3-vinylbacteriochlorophyllide d(1-) 
12-ethyl-8-propyl-3-vinylbacteriochlorophyllide d 
12-ethyl-8-propyl-3-vinylbacteriochlorophyllide d(1-) 
12-hydroxyjasmonic acid +  
12-methylpentadecanoic acid 
12-oxo-20-hydroxyleukotriene B4 
13-deoxycarminomycin 
13-hydroxy-alpha-tocopherol 
13-hydroxy-gamma-tocopherol 
13-hydroxytetradecanoic acid 
14-norpseurotin A 
15,17(3)-seco-F430-17(3)-acid 
15-hydroxyangustilobine A 
15-hydroxysolavetivone 
15alpha-stemmadenine 
15beta-stemmadenine 
16-epivincamine 
16-hydroxytriptolide 
16beta,17-dihydroxy-ent-kaurane-19-oic acid 
16R,19E-isositsirikine 
17alpha(H),21beta(H)-bishomohopanol 
17beta(H),21beta(H)-bishomohopanol 
19,20-E-vallesamine 
19-bromoaplysiatoxin 
19-Hydroxytabersonine 
1D-1-guanidino-1-deoxy-3-dehydro-scyllo-inositol 
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 
2',2'-dihydroxy-2-oxospirilloxanthin 
2',3'-dipalmitoyl-2-sulfo-alpha,alpha-trehalose(1-) 
2'-hydroxystemofoline 
2,2,3,3-tetrahydroxy-2,3-dihydronaphthalene-1,4-dione 
2,2-bis(4-chlorophenyl)ethanol 
2,2-Bis(bromomethyl)propane-1,3-diol  
2,2-dihydroxyspheroidene 
2,2-dihydroxyspirilloxanthin 
2,3,3-trimethylpentane 
2,3,9,10-Tetrahydroxyberberine 
2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline 
2,3-bis(hydroxymethyl)-7-hydroxy-6-methoxy-1-tetralone 
2,3-dihydro-3beta-methoxy withaferin A 
2,3-dihydro-3beta-O-sulfate withaferin A 
2,3-dihydrowithaferin A 
2,3-dipalmitoyl-2'-sulfo-alpha,alpha-trehalose 
2,3-dipalmitoyl-alpha,alpha-trehalose 
2,4,6-tribromophenol +   
2,4-di-tert-butylphenol  
2,4-diacetylphloroglucinol 
2,4-dibromophenol  
2,4-dichlorobenzoate 
2,4-dichlorobenzoic acid +  
2,4-didehydro-3-deoxy-L-rhamnonic acid 
2,5-bis(2-hydroxyethylamino)-3,6-diaziridinylbenzoquinone 
2,5-diiminio-3,4-bis(indol-3-yl)hexanedioate 
2,5-diimino-3,4-bis(indol-3-yl)hexanedioic acid 
2,5-hexanedione  
2,6-dibromophenol +   
2,6-dichlorobenzonitrile  
2,6-dimethyl-5-hepten-1-ol 
2,6-dimethylheptan-1-ol +  
2,7-dihydroxy-5-methyl-1-naphthoate 
2,7-dihydroxy-5-methyl-1-naphthoic acid 
2-(2-hydroxy-4-methoxyphenyl)-5-(3-hydroxypropyl)benzofuran 
2-(4-\{5-[(1H-benzimidazol-2-ylamino)methyl]thiophen-2-yl\}-1,3-thiazol-2-yl)guanidine 
2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-7H-pyrano[2,3-g][1,4]benzodioxin-7-one 
2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-7H-pyrano[2,3-g][1,4]benzodioxin-7-one 
2-(7-aminoheptyl)guanidine 
2-(hydroxymethyl)-4-(1-hydroxy-2-\{[6-(4-phenylbutoxy)hexyl]amino\}ethyl)phenol +  
2-(morpholin-4-yl)ethanol +  
2-(piperidin-1-yl)ethanol +  
2-[2-(azocan-1-yl)ethyl]guanidine 
2-[5-(benzylamino)-2-(methylsulfanyl)-6-oxopyrimidin-1(6H)-yl]-N-[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]acetamide 
2-[5-amino-2-(3-methylphenyl)-6-oxopyrimidin-1(6H)-yl]-N-[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]acetamide 
2-[6-(methoxymethyl)-4-oxo-1H-pyrimidin-2-yl]-1-(4-methylphenyl)guanidine 
2-\{3-[(3S,8aS)-1,4-dioxooctahydropyrrolo[1,2-a]pyrazin-3-yl]propyl\}guanidine 
2-amino-2-deoxy-D-galactopyranose  
2-amino-2-deoxy-D-gluconate 
2-amino-2-deoxy-D-gluconic acid +  
2-amino-3-hydroxy-4-methylbenzoyl-AMP 
2-amino-6-(1-hydroxyethyl)-7-methyl-7,8-dihydropteridin-4-one 
2-amino-6-(aminomethyl)-5-methylidene-4-oxo-1,4,5,6,7,8-hexahydropteridin-5-ium 
2-aminobenzoylacetic acid 
2-aminobenzoylacetyl-CoA 
2-aminophenol +   
2-aminopimelic acid +  
2-Bromo-5-hydroxy-N-[2-(4-hydroxyphenyl)ethyl]-4-methoxy-N-methylbenzamide 
2-bromophenol  
2-butoxyethanol +   
2-butyl-1-octanol 
2-chloro-2'-hydroxytriethylamine 
2-decaprenyl-6-methoxy-3-methyl-1,4-benzoquinone 
2-dehydro-D-gluconic acid +  
2-deoxystreptidine 
2-diethylaminoethanol +   
2-epi-5-epi-valiolone +  
2-epi-5-epi-valiolone 7-phosphate 
2-epi-5-epi-valiolone 7-phosphate(2-) 
2-epi-valiolone 
2-ethoxyethanol +   
2-Ethyl-4-methyl-1-pentanol 
2-ethylfuran 
2-ethylhexan-1-ol +   
2-guanidinopropionic acid 
2-hydroxy-5-methyl-1-naphthoate 
2-hydroxy-5-methyl-1-naphthoic acid 
2-hydroxy-7-methoxy-5-methyl-1-naphthoate 
2-hydroxy-7-methoxy-5-methyl-1-naphthoic acid +  
2-hydroxyacetophenone 
2-hydroxyethyl hexadecanoate 
2-hydroxyethyl salicylate 
2-hydroxyethyl sulfonate 
2-hydroxylaminobenzoic acid 
2-hydroxytricosanoic acid 
2-imino-3-(indol-3-yl)propanoate 
2-imino-3-(indol-3-yl)propanoic acid +  
2-isocapryloyl-3R-hydroxymethyl-gamma-butyrolactone 
2-isopropyl-5-methyl-1-heptanol 
2-methyl-1-oxo-4-[(2E,6E)-farnesyl]-3,4-dihydroquinoline-3,4-diol 
2-methyl-4-chlorophenoxybutyric acid 
2-methyl-L-tryptophan 
2-methyl-L-tryptophan zwitterion 
2-methylbutan-1-ol +  
2-methylbutyric acid +   
2-methylpropane-1,2-diol 
2-methylthioethanol 
2-nitropropane  
2-O,3-dimethylflaviolin 
2-O-(alpha-D-glucopyranosyl)glycerol 
2-O-[alpha-D-mannosyl-(1->2)-alpha-D-glucosyl]-D-glyceric acid 
2-O-alpha-D-mannosyl-1-O-\{1-O-[(10S)-10-methyloctadecanoyl]-2-O-palmitoyl-sn-glycero-3-phosphonato\}-5-O-palmitoyl-6-O-(6-O-palmitoyl-alpha-D-mannosyl)-1D-myo-inositol +  
2-O-alpha-D-mannosyl-1-O-\{1-O-[(10S)-10-methyloctadecanoyl]-2-O-palmitoyl-sn-glycero-3-phosphono\}-5-O-palmitoyl-6-O-(6-O-palmitoyl-alpha-D-mannosyl)-1D-myo-inositol 
2-O-palmitoyl-alpha,alpha-trehalose 
2-palmitoyl-3,6,6'-tristearoyl-2'-sulfo-alpha,alpha-trehalose 
2-palmitoyl-3,6,6'-tristearoyl-2'-sulfo-alpha,alpha-trehalose(1-) 
2-palmitoyl-3-stearoyl-2'-sulfo-alpha,alpha-trehalose 
2-palmitoyl-3-stearoyl-2'-sulfo-alpha,alpha-trehalose(1-) 
2-phenoxyethanol +  
2-phenylethanol +   
2-phenylethylamine +   
2-phosphinomethylmalic acid 
20(R)-tubotaiwine 
20(S)-tubotaiwine 
20-epi-isoiguesterinol 
20-hydroxy-leukotriene E4 
20-hydroxyprostaglandin A1 
20-hydroxyprostaglandin E1 
20-hydroxyprostaglandin E2 
20-oxo-5-O-beta-mycaminosyltylactone 
22-deacetylyanuthone A +  
24-dehydrozincophorin 
27-O-demethylrifamycin SV 
29-hydroxyfriedelan-3-one 
2alpha-(2'-pyrrolyl)-4alpha-methoxycarbonyl-5beta-[(2''-methyl)-heptyl]-1,3-oxazacyclohexane 
2beta-methylbacteriohopane-32,33,34,35-tetrol 
2beta-methylhop-22(29)-ene 
2beta-methylhopan-22-ol 
2beta-methyltetrahymanol 
2R-2-[(1R)-1-hydroxy-16-\{2-[10-(2-octadecylcyclopropyl)decyl]cyclopropyl\}hexadecyl]hexacosanoate 
3''-adenylylstreptomycin 
3',5'-cyclic UMP 
3'-(enolpyruvyl)uridine 5'-monophosphate 
3'-glycyl-AMP 
3'-hydroxyechinenone 
3,1'-dihydroxy-gamma-carotene 
3,17-dihydroxy-9,10-seconandrost-1,3,5(10)-triene-9-one 
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluoro-1-decanol  
3,3-dimethyloctane 
3,4,17-trihydroxy-9,10-seconandrost-1,3,5(10)-triene-9-one 
3,4,5-trihydroxy-1-cyclohexene-1-carboxylic acid 
3,4,5-trimethoxy cinnamyl alcohol 
3,4-dichloroaniline +   
3,4-dihydrospheroidene 
3,4-dihydroxymandelaldehyde 
3,4-dimethoxycinnamyl alcohol 
3,4-dimethoxyphenylethylamine 
3,4-dimethylindolyl precursor of nosiheptide 
3,4-methylenedioxymethamphetamine  
3,5-diamino-N-[amino-[(2,4-dichlorophenyl)methylimino]methyl]-6-chloro-2-pyrazinecarboxamide 
3,5-diamino-N-[amino-[(3,4-dichlorophenyl)methylimino]methyl]-6-chloro-2-pyrazinecarboxamide 
3,5-dibromo-4-hydroxybenzonitrile  
3,5-dimethoxy-4-hydroxybenzyl alcohol-4-O-beta-D-glucopyranoside 
3,6-anhydro-alpha-L-galactopyranose 
3,6-anhydro-L-galactonate 
3,6-anhydro-L-galactonic acid 
3,7,11-trimethyldodecan-1-ol 
3,9-dimethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,10-diol 
3-(1-hydroxyethyl)bacteriochlorophyllide a 
3-(1-hydroxyethyl)bacteriochlorophyllide a(2-) 
3-(1-hydroxyethyl)chlorophyllide a 
3-(1-hydroxyethyl)chlorophyllide a(2-) 
3-(4-hydroxyphenyl)lactic acid +  
3-(4-methoxyphenyl)-3-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]propanoic acid 
3-(6-chloro-3-pyridinyl)-7-azabicyclo[2.2.1]heptane 
3-(acetamidomethylidene)-2-(hydroxymethyl)succinic acid 
3-(hydroxymethyl)-6-[4-(3-methylbut-2-enyloxy)benzyl]piperazine-2,5-dione 
3-(phenethylamino)-butan-2-one 
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate 
3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid 
3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]pyruvate 
3-[(1R,2S,5R,6S)-5-hydroxy-7-oxabicyclo[4.1.0]heptan-2-yl]pyruvic acid 
3-[(1R,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid 
3-[(1S,4R)-4-hydroxycyclohex-2-en-1-yl]pyruvic acid 
3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid 
3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 
3-[(2-aminoethyl)sulfanyl]-6-methyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 
3-[(2-aminoethyl)sulfanyl]-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid 
3-[(3-aminopropyl)amino]-4-hydroxybenzoic acid 
3-[(3aS,4S,5R,7aS)-5-hydroxy-7a-methyl-1,5-dioxo-octahydroinden-4-yl]propanoic acid +  
3-[(3aS,4S,7aS)-1,5-dioxo-octahydroinden-4-yl]propanoic acid 
3-[(Z)-2-isocyanovinyl]indole 
3-acetylbenzamide 
3-acetylchlorophyllide a 
3-acetylchlorophyllide a(2-) 
3-Acetylnerbowdine 
3-amino-3-(4-hydroxyphenyl)propanoic acid 
3-amino-3-(4-hydroxyphenyl)propanoic acid zwitterion 
3-amino-4-hydroxybenzaldehyde 
3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine 
3-amino-N-(trans-3-carbamoyloxirane-2-carbonyl)-L-alanine zwitterion 
3-Bromo-1-propanol 
3-dehydro-scyllo-inosose 
3-dehydrocarnityl CoA 
3-dehydrocarnityl CoA(3-) 
3-deoxy-D-glycero-beta-D-galacto-nonulosonate 
3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid +  
3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid 9-phosphate 
3-epi-fagomine 
3-Epimacronine 
3-ethyl-1,3-dihydro-3-methoxy-2H-indol-2-one 
3-farnesyl-3-hydroxy-2-methyl-1-oxo-1lambda(5)-quinolin-4-one 
3-guanidinopropanoic acid  
3-hydroxy-2,4-dioxopentyl phosphate 
3-hydroxy-2,4-dioxopentyl phosphate(2-) 
3-hydroxy-2-hydroxymethyl-9,10-anthraquinone 
3-hydroxy-4-methylanthranilic acid +  
3-hydroxy-5-methyl-1-naphthoate 
3-hydroxy-5-methyl-1-naphthoic acid 
3-hydroxy-O,5-dimethyl-L-tyrosine 
3-hydroxybenzoate 
3-hydroxybenzoic acid +   
3-hydroxymethyl-4-methyl-furan-2(5H)-one 
3-hydroxytetradecanoic acid +  
3-hydroxytetradecanoyl-CoA 
3-iodoprop-2-yn-1-yl butylcarbamate 
3-mercaptohexanol +  
3-methoxy-5-methyl-1-naphthoate 
3-methoxy-5-methyl-1-naphthoic acid 
3-methyl-2-indolate 
3-methyl-2-indolic acid 
3-methylbenzyl alcohol  
3-methylindolyl precursor of nosiheptide 
3-methylpentanol 
3-methylquinoline  
3-methylxanthine +  
3-nitropropanoic 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-Acetylhamayne 
3-O-trans-p-coumaroyl actinidic acid 
3-sulfinopropionyl-CoA 
3-vinylbacteriochlorophyllide d 
3-vinylbacteriochlorophyllide d(1-) 
35-amino-3-methylbacteriohopane-30,31,32,33,34-pentol 
35-amino-3-methylbacteriohopane-31,32,33,34-tetrol 
35-aminobacteriohopane-30,31,32,33,34-pentol 
35-aminobacteriohopane-31,32,33,34-tetrol 
3alpha,6alpha-epoxy-4beta,5beta,27-trihydroxy-1-oxowitha-24-enolide 
3beta-hydroxycholest-5-en-26-al +  
3beta-hydroxycholest-5-en-26-oic acid +   
4,4'-diapolycopen-4-al 
4,4'-diapolycopen-4-oic acid 
4,4'-diapolycopenedioic acid 
4,4'-diaponeurosporenoic acid 
4,5-dichloro-2-n-octyl-3(2H)-isothiazolone 
4,5-dihydroxyisophthalic acid 
4-(5-O-phospho-beta-D-ribofuranosyl)phenol 
4-(phosphooxymethyl)-2-furancarboxaldehyde 
4-[(E)-\{amino[(3-methylbut-2-en-1-yl)amino]methylidene\}amino]butanoic acid 
4-\{[(E)-amino(imino)methyl]amino\}-N-(\{(2S)-1-[N-(2-naphthylsulfonyl)-L-seryl]pyrrolidin-2-yl\}methyl)butanamide 
4-amino-2,6-dinitrotoluene  
4-aminobenzenesulfonic acid 
4-Bromo-1-butanol 
4-bromophenol 
4-chlorobutanol 
4-de(dimethylamino)-4-oxoanhydrotetracycline 
4-Guanidino-1-butanol 
4-guanidinobenzoic acid 
4-guanidinobutanamide 
4-guanidinobutanoic acid 
4-guanidinobutyric acid +  
4-hydroxy-2-methyl-3-oxo-[(2E,6E)-farnesyl]-3,4-dihydroquinoline-1-oxide 
4-hydroxy-3-methoxycinnamoylagmatine +  
4-hydroxy-6-(14-hydroxytetradecyl)-pyran-2-one 
4-hydroxy-6-(15-hydroxypentadecyl)-pyran-2-one 
4-hydroxy-6-(16-hydroxy-2-oxohexadecyl)pyran-2-one 
4-hydroxy-6-(17-hydroxy-2-oxoheptadecyl)pyran-2-one 
4-hydroxy-6-methylpretetramide 
4-hydroxybutyric acid +   
4-hydroxycinnamyl alcohol +  
4-hydroxyphenylglycine +  
4-hydroxyphenylpyruvic acid oxime 
4-hydroxyprotoasukamycin +  
4-methylpent-3-en-1-ol +  
4-methylpent-3-enoic acid 
4-methylpentan-1-ol 
4-methylpentanoyl-CoA(4-) 
5''-hydroxycannabidiol 
5'-deoxyinosine 
5'-triphosphoadenylyl-(2'->5')-adenosine 
5,10-dihydro-9-dimethylallylphenazine 1-carboxylate 
5,10-dihydro-9-dimethylallylphenazine-1-carboxylic acid 
5,10-dihydrophenazine-1-carboxylate 
5,10-dihydrophenazine-1-carboxylic acid 
5,4'-dihydroxyflavone-4'-sulfate(2-) 
5-(2-hydroxyethyl)-1,3-thiazole +  
5-(2-hydroxyethyl)-4-methylthiazole 
5-(3-hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran 
5-(4-hydroxybutyl)hydantoin 
5-(N,N-hexamethylene)amiloride  
5-(N-methyl-N-propyl)amiloride 
5-[(alpha-D-glucopyranosyl-(1->2)-beta-D-galactopyranosyl)oxy]-L-lysine +  
5-amino-1-(5-phospho-beta-D-ribosyl)imidazole 
5-benzyl-1-(2-hydroxyethoxymethyl)uracil  
5-benzyloxybenzylacyclouridine 
5-bromo-8-methoxy-1-methyl-beta-carboline 
5-dehydro-L-gluconic acid 
5-epi-valiolone +  
5-epi-valiolone 7-phosphate 
5-epi-valiolone 7-phosphate(2-) 
5-fluorouracil  
5-guanidinohydantoin 
5-hydroxybenzimidazole 
5-hydroxymethylfurfural  
5-hydroxymethyluracil +  
5-methyl-1-naphthoate 
5-methyl-1-naphthoic acid 
5-methyl-1H-benzotriazole 
5-oxo-4,5-dihydro-2-furylacetate 
5-oxo-4,5-dihydro-2-furylacetic acid 
5a,11a-dehydrooxytetracycline 
6-(3'-methylbuten-2-yl)isatin 
6-(3-hydroxypropyl)thymine 
6-[3]-ladderane-1-hexanol 
6-[4-amino-4-hydroxy-2-oxo-3,4-dihydropyrimidin-1(2H)-yl]-3-[3-amino-5-(N-methylguanidino)pentanoylamino]-3,6-dihydro-2H-pyran-2-carboxylic acid 
6-\{[(4R,5R)-4-(hydroxymethyl)thymin-5-yl]methyl\}thymine 
6-diazo-5-oxo-L-norleucine 
6-guanidinohexanoic acid 
6-hydroxymanzamine A 
6-ketopiperidine-2-carboxylic acid 
6-linalyl-2-O,3-dimethylflaviolin 
6-methylheptan-1-ol +  
6-methylpretetramide 
6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole +   
6:2 fluorotelomer unsaturated carboxylic acid 
6alpha-methylprednisolone +   
7'-hydroxyabscisic acid 
7,12-dioxolithocholic acid 
7,8-dihydroxanthopterin 
7-demethoxyegonol 
7-deoxyloganetic alcohol 
7-epi-cylindrospermopsin 
7-epi-ent-eudesmane-5,11-diol 
7-hydroxycannabidiol 
7-O-geranyl-2-O,3-dimethylflaviolin 
7alpha-hydroxypregnenolone 
8'-epi-cleomiscosin A 
8,12-diethyl-3-vinylbacteriochlorophyllide d 
8-demethyl-8-(2,3,4-O-trimethyl-alpha-L-rhamnosyl)tetracenomycin C 
8-demethyl-8-(2,3-O-dimethyl-alpha-L-rhamnosyl)tetracenomycin C 
8-demethyl-8-(2-O-methyl-alpha-L-rhamnosyl)tetracenomycin C 
8-demethyl-8-(alpha-L-rhamnosyl)tetracenomycin C 
8-demethyltetracenomycin C 
8-hydroxyadenine 
8-hydroxymanzamine A 
8-methylmenaquinol-6 
8-methylmenaquinone-6 
8:2 fluorotelomer unsaturated carboxylic acid 
9'-hydroxyabscisic acid 
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oate 
9,17-dioxo-1,2,3,4,10,19-hexanorandrostan-5-oic acid +  
9-(2-\{[amino(iminio)methyl]amino\}ethoxy)-3-(2-deoxy-5-O-phosphono-beta-D-ribofuranosyl)-3H-pyrimido[5,4-b][1,4]benzoxazin-2(10H)-one 
9-HEPE 
9-methyldecan-1-ol 
9-O-Demethyl-2alpha-hydroxyhomolycorine 
9-O-Demethylhomolycorine 
9beta-pimara-7,15-dien-19-ol 
[(3S)-4-(6-methylheptanoyl)-5-oxooxolan-3-yl]methyl phosphate 
[3-(2,2,3-trimethylcyclopent-3-enyl)cyclohex-3-enyl]methanol 
[4-(2,2,3-trimethylcyclopent-3-enyl)cyclohex-3-enyl]methanol 
[4-(6-methylheptanoyl)-5-oxo-2,5-dihydrofuran-3-yl]methyl phosphate 
[5-(aminomethyl)-3-furyl]methyl diphosphate 
[5-(aminomethyl)-3-furyl]methyl phosphate 
[N-(4-cyanophenyl)-N'-(diphenylmethyl)guanidine]acetic acid  
\{3-[(1,3,2-dioxaborolan-2-yl)oxy]propyl\}guanidine 
A-230 nerve agent 
A-232 nerve agent 
A-234 nerve agent 
abafungin 
Ac-(D)Phe-Pro-boroArg-OH 
acamprosate  
acesulfame 
acetamiprid +   
acetochlor  
acetophenone +   
acetyl phosphate(2-) 
acetylagmatine 
acetylblasticidin S 
acetylcaranine 
acetylpyruvic acid +  
aclacinomycin A  
aclacinomycin S 
aclacinomycin S zwitterion 
aconine 
acrolein +   
acromelic acid A 
acronycine 
acrylamide  
actinorhodin 
Acutumidine 
Acutumine 
adenine arabinoside +   
adenosylhopane 
adonixanthin 
adrenosterone  
Affinine 
agarose +  
ageladine A  
agmatine +   
agrocin 84 
ajaconine 
aklaviketone 
Akuammine 
Ala-Lys 
alachlor  
alamarine 
alatolide 
albaflavenone 
Albomaculine 
albomycin delta1 +  
albomycin delta2 +  
albomycin epsilon +  
albuterol +   
alkaloid antibiotic +   
alkaloid ester +   
alkanesulfinate +  
all-trans-3,4-didehydro-13,14-dihydroretinol 
all-trans-4-hydroxyretinal 
all-trans-7,8-dihydroretinol 
allocholic acid +  
allodeoxycholic acid +  
Aloperine  
alpha-allenylagmatine 
alpha-mycolic acid 
alpha-N-substituted L-arginine +   
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-Neup5Ac-(2->8)-alpha-Neup5Ac-(2->8)-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 
Alpinine 
alprazolam  
Ambelline 
ambiguine H 
ambiguine I 
amidinoproclavaminic acid 
amidotrizoic acid +   
amiloride +   
aminoguanidine +   
aminophenazone  
aminopotentidine 
aminopyrrolnitrin 
amisulpride  
amitraz  
amitriptyline +   
ammonia +   
Ammothamnine  
amphetamine +   
amphotericin B +   
Anagyrine 
andrastin B +   
andrographolide  
angucycline +   
angustilobine B, (rac)- 
ankorine 
annomontine  
antazoline  
antelmycin 
antheraxanthin 
anticapsin 
anticapsin zwitterion 
antipyrine +   
aplysiatoxin 
aplysinoplide A 
aplysinoplide B 
aplysinoplide C 
Apovincamine 
apraclonidine +  
argatroban  
Argentine 
arginine +   
aristolochic acid +   
Aroclor 1254  
aromatic primary alcohol +   
arsenoacetic acid 
arsenocholine 
aryllmethyl dialkyl phosphate 
ascidiathiazone A 
ascidiathiazone B 
ascomycin  
aspartame  
aspernidine A 
aspernigrin A +  
asperparaline A 
Aspidospermatine 
asukamycin 
asulam 
atenolol +   
atomoxetine +   
atorvastatin 
atorvastatin calcium trihydrate 
atraton 
atrazine +   
aurachin A 
aurachin B 
aurachin C +  
aurasperone B 
aurasperone C 
aureothin 
autoinducer-2 
avermectin +   
avilamycin A 
avilamycin A precursor 
azithromycin +   
azoxybacilin 
azoxystrobin  
bacillaene 
bacillithiol 
bacterial xenobiotic metabolite +   
bacteriochlorophyllide a +  
bacteriochlorophyllide a(2-) +  
bacteriochlorophyllide g 
bacteriochlorophyllide g(2-) 
bacteriohopane-32,33,34,35-tetrol +  
bacteriohopanetetrol cyclitol ether 
bacteriohopanetetrol glucosamine 
bacterioruberin 
bafilomycin A1  
Baloxine 
Baptifoline 
BAR0329 
barbituric acid +   
Batrachotoxin 
batzelladine A 
batzelladine B 
benserazide  
bentazone  
benzamidoxime  
Benzamil  
benzazepine alkaloid +   
benzo[d]isothiazol-3-one  
benzodiazepine alkaloid 
benzothiazole +   
benzotriazole +   
benzoylagmatine 
benzoylhypaconine  
Berberastine 
beta-carboline +   
beta-cyclocitral +   
beta-D-galactopyranosyl-(1->4)-beta-D-galactopyranose 
beta-D-galactosyl-(1<->1')-N-(docosanoyl)hexadecasphingosine 
beta-D-galactosyl-(1<->1')-N-docosanoyl-(4E,14Z)-sphingadienine 
beta-D-galactosyl-(1<->1')-N-henicosanoyl-(4E,14Z)-sphingadienine 
beta-D-galactosyl-(1<->1')-N-icosanoyl-(4E,14Z)-sphingadienine 
beta-D-glucosyl-(1<->1')-N-(docosanoyl)hexadecasphingosine 
beta-D-glucosyl-(1<->1')-N-docosanoyl-(4E,14Z)-sphingadienine 
beta-D-glucosyl-(1<->1')-N-henicosanoyl-(4E,14Z)-sphingadienine 
beta-D-glucosyl-(1<->1')-N-icosanoyl-(4E,14Z)-sphingadienine 
beta-D-Manp-(1->4)-D-Glcp 
beta-dihydromenaquinone-9 
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-geranylfarnesene 
beta-guanidino-L-alanine 
beta-heptaprene 
beta-hexaprene 
beta-L-altrose +  
beta-L-Ara4N-lipid A +  
betalain +   
bethanidine +  
betrixaban 
bezafibrate  
bicalutamide  
bicuculline  
bidenlignaside A 
biguanide +   
biguanides +   
bilanafos 
biliatresone 
biliverdin delta 
bis(2-butoxyethyl)phthalate 
bisanhydrobacterioruberin 
bisindole alkaloid +  
bisperfluorodecyl phosphate 
bisperfluorooctyl phosphate 
bisphenol A +   
blasticidin S +  
bleomycin A5  
Bonafousine 
bongkrekic acid  
boromycin 
borrelidin  
boscalid +  
bosentan +   
brasilicardin A 
bromacil  
bromodeoxytopsentin 
bromomethane  
bromotopsentin 
brovincamine 
Brovincamine fumarate 
bryostatin 1  
bryostatin 2  
buddlenol A 
buddlenol B 
buddlenol C 
bunodosine 391 
bupropion +   
butachlor  
butan-1-ol +   
butan-2-one +   
butane-1,4-diol +   
butyn-1-ols +  
Bz-Arg-OEt 
C-Curarine 
caerulomycin A 
caerulomycin C 
caerulomycin F 
caerulomycin G 
caerulomycin H 
caerulomycin I 
caerulomycin J 
caerulomycin K 
caerulomycinamide 
caerulomycinonitrile 
cafestol  
caffeine +   
caldopentamine 
caldopentamine(4+) 
caldopentamine(5+) 
Calebassone 
callipeltin A 
camostat methanesulfonate 
candesartan  
candicidin 
candicidin D +  
Candimine 
Capaurine 
Caracurine V 
caracurine VII 
carbamazepine +   
carbazole alkaloid +  
carbetamide 
carbon monoxide  
Caribine 
carpaine 
carpropamid +  
Caseadine 
Catharine 
caulophine 
Caulophylline 
Cavinine 
celasdin B 
cembrene C +  
ceratamine A 
ceratamine B 
cetirizine  
cetoniacytone A 
chanoclavine-I +  
cheilanthifoline 
chitotriose 
chloral hydrate  
Chlorhexidine hydrochloride 
chloridazon 
chlorobactene 
chloroeremomycin 
chloromethane  
chloromethylisothiazolinone +   
chloroorienticin B 
chlorotoluron  
chloroxanthin 
chlorpyrifos  
chlorpyrifos-methyl  
chondramide +  
chondramide A +  
chondramide B 
chondramide C +  
chondramide D 
chondrochloren A 
chondrochloren B 
chromomycin +  
chromopyrrolic acid 
chrysanthemol +   
chrysobactin 
chrysogedone B 
ciguatoxin +   
cilastatin  
cimetidine +   
cinnamyl alcohol +   
ciprofloxacin +   
circumdatin H 
cis-3-hydroxy-D-proline 
citalopram  
clarithromycin  
clavaldehyde 
clavaldehyde(1-) 
clavulanic acid 
cleomiscosin A 
climbazole  
clindamycin +   
clionasterol 
clitidine 
clomazone 
clonidine +   
clopenthixol +   
clothianidin +   
clotrimazole  
clozapine  
CMP-3-deoxy-D-glycero-beta-D-galacto-nonulosonic acid 
CMP-5'-phosphonoformic acid 
CMP-8-amino-3,8-dideoxy-alpha-D-manno-oct-2-ulosonic acid 
cobalt(II)-factor IV 
cobalt(II)-factor IV(6-) 
cocaine  
codeine +   
coelenterazine 2-hydroperoxide 
coelichelin 
coelichelin(3-) +  
coelimycin P1 
colchicine +   
Colchicoside 
concanamycin +   
conglobatin 
coptisine  
coral metabolite +  
Coronaridine 
Corynantheidine 
corynebactin 
coumermycin A1 
crambescidin 800 
crambescidin 826 
crassicauline A 
creatine +   
Crinamidine 
Crinamine 
Crinine 
croomine 
crotyl alcohol +   
cryptopleurine 
Cularicine 
Cularidine 
Cularimine 
Cularine 
curamycin A 
cyanazine +   
cyanotoxin +   
cyanuric acid  
cyclo(L-Leu-L-Pro) 
cyclohexadienol +  
cycloheximide  
cyclooctasulfur 
cyclooctatin +  
cyclophosphamide +   
cylindrospermopsin  
cylindrospermopsins +   
cymoxanil 
Cypridina luciferin +  
cyproconazole  
cyprodinil  
Cys-Ser 
cystodytin D +  
cystodytin E +  
cystodytin F 
cystodytin G 
cystothiazole A 
cytisine  
cytochalasan alkaloid +   
cytochalasin D  
cytosporic acid 
cytosylglucuronate 
cytosylglucuronic acid 
D-2,4-diaminobutyric acid 
D-4-hydroxyphenylglycine zwitterion 
D-allothreonine 
D-altritol 
D-erythrulose 4-phosphate 
D-erythrulose 4-phosphate(2-) 
D-glucose-(13)C6 
D-isoleucine +  
D-isoleucinium 
D-leucinate 
D-leucine +  
D-leucinium 
D-lysinate 
D-lysine +  
D-lysinium(1+) +  
D-lysinium(2+) 
D-nopaline 
D-octopine 
D-tryptophan +  
D-tryptophanate +  
D-tryptophanium 
D-tryptophanyl radical +  
D-xylose 5-phosphate 
daedalin A 
danielone 
dapdiamide +  
dapdiamide A zwitterion 
dapdiamide B zwitterion 
dapdiamide C zwitterion 
dapdiamide E zwitterion 
daptomycin 
daunorubicin +   
Deacetylcolchicine 
debromoaplysiatoxin 
decabromodiphenyl ether  
decahydroquinoline alkaloid +  
decan-1-ol +   
Decarbamoylgonyautoxin 1 
decarbamoylsaxitoxin 
A pyrrolopurine that is 2,6-diiminodecahydropyrrolo[1,2-c]purine carrying an additional hydroxymethyl substituent at position 4 as well as two hydroxy substituents at position 10. A toxin that is isolated from marine dinoflagellates and cyanobacteria and is known to cause paralytic shellfish poisoning.
decyl palmitate 
decyl sulfate 
decylamine-N,N-dimethyl-N-oxide 
Dehydrocorydaline 
Dehydrocorydalmine 
Dehydrocorytenchine 
dehydrodiconiferyl alcohol +  
deoxyamidinoproclavaminic acid 
deoxycylindrospermopsin 
deoxylimonoic acid D-ring-lactone 
deoxynivalenol  
deoxyspectinabilin +  
deoxyviolacein 
deoxyviolaceinate 
deoxyviolaceinic acid 
desferricoprogen 
desferricoprogen B 
desferrioxamine E 
desmedipham 
devancoaminyl vancomycin 
dexamethasone +   
dexormaplatin 
dextromethorphan +   
diazepam +   
diazinon  
dibenzodioxine +   
dibenzofuran +   
dibromoacetic acid  
dibromomethane  
dicamba  
dicerandrol A 
dicerandrol B 
dichloroacetic acid +   
dichlorprop 
diclocymet 
diclofenac +   
Didehydrostemofoline 
dieldrin  
diethyl phthalate  
diethylene glycol monoethyl ether  
difenoconazole  
diflufenican 
diglyme 
dihydrobisanhydrobacterioruberin 
dihydroconiferyl alcohol +  
dihydroconiferyl alcohol glucoside 
Dihydrocorynantheine 
dihydrogenistein +  
dihydroisopentenyldehydrorhodopin 
dihydromotuporamine C 
dihydrostemphyloxin I 
dihydroxy mycolic acid 
dimercaprol +   
dimethachlor 
Dimethamine 
dimethenamid 
dimethoate  
dimethomorph  
dimethyl sulfide +  
dinitrogen oxide  
dinoseb +   
dipicolinic acid +   
diuron  
docebenone  
dodec-10-yn-1-ol 
dodecan-1-ol +   
dodecyl sulfate +   
domoic acid  
drimenol +   
dronedarone  
dTDP-3,4-didehydro-2,6-dideoxy-alpha-D-glucose 
dTDP-4-(methylamino)-2,3,4,6-tetradeoxy-alpha-D-glucose 
dTDP-4-(methylammonio)-2,3,4,6-tetradeoxy-alpha-D-glucose(1-) 
dTDP-4-amino-2,3,4,6-tetradeoxy-alpha-D-glucose 
dTDP-4-dehydro-2,3,6-trideoxy-alpha-D-glucose 
dTDP-4-dehydro-2,3,6-trideoxy-alpha-D-glucose(2-) 
dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose 
dTDP-4-dehydro-2,6-dideoxy-alpha-D-glucose(2-) 
dTDP-alpha-D-forosamine 
dTDP-alpha-D-forosamine(1-) 
dTDP-beta-L-daunosamine 
dTDP-beta-L-daunosamine(1-) 
Dubiusine 
duvoglustat +   
E64 
Eburnamine 
Eburnamonine  
echinenone +  
edifenphos  
egonol +  
EI-1511-5 
EI-1625-2 
ekatetrone 
elaiophylin 
elloramycin A 
eltrombopag  
Elymoclavine 
emamectins +   
ent-6alpha-Hydroxybuphanisine 
ent-6beta-Hydroxybuphanisine 
entecavir (anhydrous) +  
enterobactin +  
enterobactin(1-) 
epibatidine  
epinastine +   
epipinoresinol 
epithienamycin E 
epothilone +   
epoxiconazole  
eprosartan +  
equisetin 
ergoline alkaloid +   
ergometrine +  
erucifoline +  
erucifoline N-oxide 
Erysonine 
Erysotrine 
Erythratidine 
erythrodiol +  
erythromycin +   
erythromycin A(1+) 
Escherichia coli metabolite +   
ethambutol +   
ethanol +   
ethanolamine +   
ethanols +   
ethofumesate 
ethyl (5Z,8Z,11Z,14Z,17Z)-icosapentaenoate 
ethylene glycol +   
ethylene glycol monododecyl ether 
ethylisopropylamiloride  
everolimus  
exemestane  
famotidine +   
farnesol +   
fenofibrate  
fenoxanil 
fenoxycarb  
fenpropidin 
fenpropimorph 
ferric yersiniabactin 
ferrioxamine E 
feruloylagmatine +  
ficusequilignan A 
fidaxomicin 
filiforminol 
filipin III  
fingolimod phosphate 
fipronil  
flavasperone 
flavuxanthin 
flexirubins +  
flonicamid 
Floramultine 
fluazifop 
fluazinam  
fluconazole +   
flufenacet  
flumequine  
fluorenes +   
fluoxetine  
flupenthixol  
fluroxypyr 
flusilazole  
FMN +   
fonsecin +  
foramsulfuron 
foresaconitine 
formobactin 
fortimicin KK1 
fosmidomycin 
FR901463 
FR901464 
FR901465 
fucoidan  
fucoxanthin  
furanomycin 
furfuryl alcohol +   
furosemide  
fusicoccin 
gabapentin +   
gabexate methanesulfonate 
Gabunamine 
Galegine 
gamma-butyrolactone +  
gamma-glutamyltyramine 
gamma-hydroxyarginine +  
ganoderone A 
ganoderone C 
GDC-0879 
GDP-N,N'-diacetylbacillosamine 
GDP-N,N'-diacetylbacillosamine(2-) 
geissoschizoline 
gelatin 
gellan gum 
gemcitabine +   
geraniol +   
Germine 
gibberellin A15 (lactone form) +  
gibberellin A7 
Glaziovine 
glomosporin 
glycidol +   
glycolic acid +   
glycosmisic acid +  
glycosmisic acid 4'-sulfate 
Gonyautoxin 1 
Gonyautoxin 2 
Gonyautoxin 5 
griseochelin 
guaiacylglycerol beta-coniferyl ether 
guaiacylglycerol beta-scopoletinyl ether 
guanadrel 
guanazodine 
guancidine 
guanethidine +   
guanidine +   
guanidinoacetic acid 
guanidinoethyl methyl phosphates +  
guignardone N 
Haemanthamine 
Haemanthidine 
Hamayne 
hapalindole +  
hapalindole H 
harmala alkaloid +   
Harringtonine 
hederacine A 
hederacine B 
Helminthosporol 
hentriacontan-1-ol 
heptacosan-1-ol 
heptadecan-1-ol +  
Herdmanine A 
Herdmanine B 
herquline B 
hex-2-ulofuranosyl hexopyranoside 
hexadecan-1-ol +  
hexamidine 
hexan-1-ol +   
hexane +   
hexane-1,6-diol +  
Hirsuteine 
homoplatensimide A +  
homoplatensimide A methyl ester 
hop-17(21)-ene +  
hop-21(22)-ene +  
hordatine A 
hordatine B 
hydramethylnon +   
hydrochlorothiazide  
hydrogen peroxide +   
hydrogen sulfide +   
hydroxyacetone +  
hydroxyalbendazole 
hydroxychloroquine  
hydroxytyrosol +   
hygrolidin 
hypaconine 
hypaphorine 
hypotaurocyamine +  
hyrtial 
Ibotenic acid  
ibuprofen +   
idebenone  
ifosfamide  
ikarugamycin 
imazamox  
imidacloprid +   
imidazole-4-methanol 
iminoarginine 
iminoctadine +  
Imperialine 
indan-1-ol  
indanomycin 
indicanone 
indigoidine 
indirubin-3'-monoxime  
indol-3-ylacetaldehyde  
indole alkaloid +   
indole-3-acetamide 
indole-3-carbaldehyde 
indole-3-carboxylic acid +   
indolizidine alkaloid +   
indolmycenic acid 
indolmycin 
indolyl alcohol +   
indometacin +   
integrastatin A 
iobitridol 
iohexol  
iomeprol  
iooxitalamic acid  
iopamidol  
iopromide  
ioxynil  
iprovalicarb 
irbesartan  
irgarol 1051 
isoamylol +   
isobrucine 
isobrucine N-oxide 
isobutanol +   
Isococculidine 
isocyanuric acid +   
isogeraniol +  
isoglutamic acid 
Isomatrine 
isonocardicin C 
isopentenyl alcohol +  
isopentenyldehydrorhodopin 
isopentylamine 
isoproturon  
isopseudostrychnine 
isoquinoline alkaloid +   
isoretuline 
isostrychnine 
isostrychnine N-oxide 
isotanshinone IIB 
isotaxiresinol 
jadomycin B 
Jamine 
jaspamide  
jaspamide B 
jaspamide C 
jaspamide D 
jaspamide E 
jaspamide F 
jaspamide G 
jaspamide H 
jaspamide J 
jaspamide L 
jaspamide M 
jasplakinolide D 
jasplakinolide Q 
jasplakinolide R1 
Jatrorrhizine  
K-252a +   
kahweol  
kalimantacin A 
kalimantacin B 
kalimantacin C 
kanamycin A +   
kanamycin A(4+) +  
karakoline 
kasugamycin 
ketamine +   
ketoprofen  
KN-93  
kojic acid  
kresoxim-methyl  
Kreysigine 
L-2-aminopentanoic acid 
L-2-aminopentanoic acid zwitterion 
L-altrarate(1-) 
L-altraric acid 
L-arginine amide 
L-arginine hydroxamate 
L-beta-ethynylserine 
L-BMAA 
L-dihydroanticapsin 
L-djenkolic acid 
L-dopa +  
L-erythrulose 4-phosphate 
L-erythrulose 4-phosphate(2-) 
L-homophenylalanine 
L-phenylalaninol +  
L-proline betaine 
L-ribonic acid 
L-tagatofuranose 6-phosphate(2-) 
laccaic acid B +  
lactucin +  
lactucopicrin 
lamellarin alpha 20-hydrogen sulfate 
laminarin 
lamivudine  
lamotrigine  
lancovutide 
lanosterol +   
lanthionine +   
latrunculin A  
latrunculin B  
laureth-5 
lavandulol +  
lead chromate  
lead(0) +   
lejimalide A 
lejimalide B 
lenacil 
leptomycin A 
leptomycin B  
leucomycin +  
leucomycin V 
leuconoxine 
leupeptin  
levetiracetam  
levodione 
lidocaine +   
lincomycin +   
linuron  
lipid A 1,4'-bis(2-aminoethyl diphosphate) 
lissoclibadin 1 
lissoclibadin 2 
lissoclibadin 3 
lombricine +  
long chain primary alcohol +   
loprodiol 
loxtidine  
LSM-1309 
LSM-1372 
LSM-1597 
LSM-16753 
LSM-18556 
LSM-1944 
LSM-22634 
LSM-24185 
LSM-4236 
LSM-4502 
LSM-5249 
LSM-6354 
LSM-6387 
LSM-6464 
LSM-6667 
lucensimycin E 
lycojapodine A 
lycoperine A 
Lycorenine 
lyratol C 
macrocin 
malacidin A 
malacidin B 
mancozeb  
maneb +   
manzamine A +  
marianoside A 
marine xenobiotic metabolite +   
massadine 
Matrine  
Me-YTM-T 
Mecambrine 
mecoprop  
mefenamic acid  
mephedrone  
mercaptoethanol +   
mercury(0)  
meso-zeaxanthin 
mesotrione +   
metalaxyl 
metamitron +  
metazachlor  
metformin  
metformin hydrochloride +  
methadone +   
methamphetamine +   
methane +   
methanol +   
methiocarb  
methomyl +   
methoxy mycolic acid 
methoxyfenozide  
methyl 2-(hydroxymethyl)pyrrolidine-1-carboxylate 
methyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate 
methyl 5-(hydroxymethyl)pyrrolidine-2-carboxylate 
methyl 5-(hydroxymethyl)pyrrolidine-3-carboxylate 
methyl gamma-D-aspartate 
methyl gamma-linolenate 
methyl pentadecanoate 
methyl tuberonate 
methylguanidine +  
methymycin 
metoclopramide  
metolachlor  
metoprolol  
metribuzin 
metronidazole +   
metsulfuron methyl  
microcystin LF  
microcystin LW 
microcystin RR  
microcystin-LR  
milbemycin +   
mitoguazone 
mitomycin +   
mitomycin A 
moclobemide  
mollisoside A 
mono(5-carboxy-2-ethylpentyl) phthalate  
monoamine alkaloid +  
monoanhydrobacterioruberin 
monodechloroaminopyrrolnitrin 
monuron  
morphine +   
mupirocin 
muramic acid +  
muscimol  
mutalomycin 
mycinamicin +  
myclobutanil 
mycophenolic acid +   
Mycoplasma genitalium metabolite +   
mycothiol +  
mycotoxin +   
myriaporone 3 
myristyl palmitate 
myxochelin B 
N(1)-aminoaminopropylagmatine 
N(2)-(2-carboxyethyl)-L-arginine 
N(2)-\{[(1R)-1-(4-bromophenyl)ethyl]carbamoyl\}-L-asparaginyl-N-\{(1S)-4-carbamimidamido-1-[(S)-(2S)-2,3-dihydro-1,3-thiazol-2-yl(hydroxy)methyl]butyl\}-L-valinamide 
N(2)-carbamimidoyl-N-\{2-[4-(3-\{4-[(5-carboxyfuran-2-yl)methoxy]-2,3-dichlorophenyl\}-1-methyl-1H-pyrazol-5-yl)piperidin-1-yl]-2-oxoethyl\}-D-leucinamide 
N(3)-fumaramoyl-(S)-2,3-diaminopropanoic acid 
N(3)-fumaroyl-(S)-2,3-diaminopropanoic acid 
N(4)-aminopropylspermidine 
N(4)-aminopropylspermidine(4+) 
N(4)-aminopropylspermine 
N(4)-aminopropylspermine(5+) 
N(4)-bis(aminopropyl)spermidine(1+) 
N(4)-bis(aminopropyl)spermidine(5+) 
N(4)-demethyl-12-methoxyalstogustine 
N(5)-methyl-L-arginine 
N(gamma)-nitro-L-arginine 
N(omega),N'(omega)-dimethyl-L-arginine +  
N(omega),N(omega)-dimethyl-L-arginine +  
N(omega)-methyl-L-arginine 
N(omega)-methyl-L-arginine zwitterion 
N,N'-(p-xylylidene)bis(aminoguanidine) +  
N,N,N-trimethylglycyl-CoA 
N,N,N-trimethylglycyl-CoA(3-) 
N,N-diethyl-m-toluamide  
N-(2-\{4-[3-(4-\{[4-(acetylamino)benzyl]oxy\}-2,3-dichlorophenyl)-1-methyl-1H-pyrazol-5-yl]piperidin-1-yl\}-2-oxoethyl)-N(2)-carbamimidoyl-D-leucinamide 
N-(2-hydroxyethyl)-beta-alanine 
N-(3-oxododecanoyl)-L-homoserine lactone 
N-(gamma-L-glutamyl)-L-alaninol 
N-(gamma-L-glutamyl)-L-alaninol zwitterion 
N-(hydroxymethyl)phthalimide +   
N-[(+)-12-hydroxy-7-isojasmonyl]isoleucine 
N-[(1R)-2-\{(2S)-2-[(3-carbamimidamidopropyl)carbamoyl]piperidin-1-yl\}-1-(cyclohexylmethyl)-2-oxoethyl]glycine 
N-[(1S)-1-(1,3-benzothiazol-2-ylcarbonyl)-4-carbamimidamidobutyl]cyclopentanecarboxamide 
N-[(1S)-1-\{[(1S)-4-[(diaminomethyl)amino]-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl\}-2-methylpropyl]-4-methylpentanamide 
N-[(1S)-1-\{[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]carbamoyl\}-2-methylpropyl]-2-(3-chlorophenyl)-2-oxoacetamide 
N-[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]-2-[2-(3,4-dichlorophenyl)-5-[(1-methylethyl)amino]-6-oxopyrimidin-1(6H)-yl]acetamide 
N-[(1S)-4-carbamimidamido-1-(1,3-thiazol-2-ylcarbonyl)butyl]-2-[2-(3-methylphenyl)-6-oxo-5-[(quinolin-8-ylmethyl)amino]pyrimidin-1(6H)-yl]acetamide 
N-[(2S)-2-amino-2-carboxyethyl]-L-glutamic acid 
N-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl]-L-glutamic acid 
N-[2-(3,4-diethoxyphenyl)ethyl]-4-phenoxybenzamide 
N-\{(1S)-4-carbamimidamido-1-[(S)-hydroxy(1,3-thiazol-2-yl)methyl]butyl\}-N(2)-carbamoyl-L-valinamide 
N-\{[(2S)-1-(N-\{[cis-4-(carbamimidamidomethyl)cyclohexyl]carbonyl\}-3-cyclohexyl-D-alanyl)azetidin-2-yl]carbonyl\}-D-tyrosyl-N(6)-carbamimidoyl-L-lysinamide 
N-acetyl-D-glucosamine +   
N-acetyl-D-mannosamine +  
N-acetyldopamine  
N-acetylneuraminic acid +   
N-acetylneuraminol +  
N-acyl-L-arginine +  
N-acylethanolamine +   
N-amidino-L-aspartate(2-) 
N-amidino-L-glutamic acid 
N-amidinoaspartic acid +  
N-benzoyl-L-phenylalaninol +  
N-butyl-N-(4-hydroxybutyl)nitrosamine +   
N-butylbenzenesulfonamide  
N-carbamimidoylpiperidine +  
N-demethylindolmycin 
N-ethyl-N-(2-hydroxyethyl)nitrosamine 
N-ethyldiethanolamine 
N-ethylperfluorooctane sulfonamidoacetic acid 
N-Formyldemecolcine 
N-guanylhistamine 
N-hexadecanoylglycine +  
N-hydroxy-2-methylpropanamine 
N-hydroxy-PhIP  
N-hydroxydebrisoquine O-glucuronide 
N-hydroxyguanidine 
N-isopropyl-L-glutamine 
N-isopropyl-L-glutamine zwitterion 
N-methyl-4-phenylpyridinium  
N-methylcheilanthifoline 
N-methylhydantoin 
N-methylnicotinate  
N-methylperfluorooctane sulfonamidoacetic acid 
N-methylphenylethanolamine 
n-octyl sulfate 
nafamostat  
nafamostat methanesulfonate 
naltrexone  
nanaomycin A 
naphthalene-2,7-disulfonic acid 
naphthalene-2-sulfonic acid 
naphthylmethanol +  
napropamide  
naproxen +   
narbomycin 
negundin B 
neohesperidin dihydrochalcone  
neomethymycin 
neonicotinoid insectide +   
neopikromycin 
neopikromycin(1+) 
neotame  
neothyonidioside 
neotuberostemonine 
nereistoxin 
neriifolin +  
nicosulfuron 
nicotine +   
nigerazine A 
nigerazine B 
nigericin  
nigragillin 
ninhydrin 
nitensidine E 
nitroglycerin  
nitroguanidine derivative +   
nitroguanidine insecticide 
Nobilisitine A 
nocamycin E +  
nocamycin E(2-) 
nocamycin I 
nocamycin I(1-) 
nocardicin C 
nocardicin G 
nogalaviketone 
nogalonic acid +  
nonadec-1-ene 
nonaflavuxanthin 
nonyl palmitate 
norfloxacin  
norverapamil  
nostocarboline 
novamethymycin 
novapikromycin 
novclobiocin 109 
nylons 
nystatins +   
O-acetyl-L-serine +  
o-aminoacetophenone 
O-Methyllycorenine 
octadecan-1-ol +   
octadecane +   
octadienol +   
octan-1-ol +   
octane +   
octhilinone 
octyl palmitate 
okadaic acid  
oleandomycins +   
oligomycin +   
olivomycin +  
oltipraz  
omega-3 fatty acid +   
omega-conotoxin GVIA  
omega-hydroxy fatty acid +   
omega-hydroxy-beta-dihydromenaquinone-9 
omega-hydroxymenaquinone-4 
omega-hydroxyphylloquinone 
opine +  
orbencarb 
oriciacridone C 
oriciacridone F 
orlistat  
ormaplatin 
orotidine 
oseltamivir +   
ospemifene  
ossamycin 
ovothiol A 
ovothiol B 
ovothiol C 
oxazepam  
oxetanocin A +  
oxidized Cypridina luciferin 
oxidopamine  
oxybenzone  
oxyprotostemonine 
oxytetracycline  
p-coumaroylagmatine +  
p-methoxybenzaldehyde  
paeonilactinone 
paerucumarin 
palmitoyllipid A 
pamapimod 
Panamine 
pantoprazole  
papuamide B 
paracetamol +   
parasiloxanthin 
pateamine 
pectenotoxin-11 
pederin 
peloruside A 
penipanoid B 
pentadecan-1-ol 
pentaerythritol 
pentalen-13-ol 
pentalenolactone 
pentalenolactone D 
pentalenolactone E 
pentalenolactone F 
pentamidine  
pentan-1-ol +   
penten-1-ols +  
peramivir 
perfluorobutyric acid  
perfluorodecanoic acid  
perfluorodecyl phosphate 
perfluoroheptanoic acid  
perfluorohexanoic acid  
perfluorononanoic acid  
perfluorooctane sulfonamidoacetic acid 
perfluorooctanoic acid  
perfluorooctyl phosphate 
perfluoropentanoic acid 
perfluoroundecanoic acid  
pethoxamide 
phaseolotoxin 
Phellodendrine  
phenanthrene alkaloid +  
phenanthrenes +   
phenazine-1,6-dicarboxylic acid 
phenazine-1-carboxylic acid  
phencyclidine  
phenethylamine alkaloid +   
phenmedipham 
phenyl biguanide  
phenylacetic acid +   
Phenylamil  
phenylhydrazine +   
phleomycin D1 +  
phosphatidyl-myo-inositol 6-acylmannoside(1-) 
phosphatidylcholine (16:0/20:5) 
phosphinomethylisomalic acid 
phosphoramidon  
phyllospadine 
phytotoxin +   
piericidin A  
pikromycin 
pinoxaden 
pinoxaden acid +  
pioglitazone +   
pipercallosidine 
pipercallosine 
piperidine alkaloid +   
piperlactam S 
Piptanthine 
pirimicarb  
plakortide F free acid 
platencin +  
platencin A1 +  
platencin A1 methyl ester 
platencin A2 +  
platencin A2 methyl ester 
platencin A3 +  
platencin A3 methyl ester 
platensimycin +  
platensimycin A1 +  
platensimycin A1 methyl ester 
platensimycin A2 methyl ester 
platensimycin A3 methyl ester 
platensimycin A4 methyl ester 
platensimycin A5 methyl ester 
platensimycin B2 
platensimycin B3 
platensimycin B4 +  
platensimycin B4 methyl ester 
platensimycin methyl ester 
platensin A4 
plaunotol  
plitidepsin  
PM-94128 
poly(glycerol phosphate) anion 
poly(glycerol phosphate) macromolecule +  
polyhydroxyalkanoate 
polyoxin +  
potassium cyanide  
pradimicin +  
pravastatin  
precursor Z hydrate 
prednisolone +   
premithramycin A2' 
premithramycin A3' 
prenderol 
Pretazettine 
primary allylic alcohol +   
primary alpha-hydroxy ketone +   
primary fatty alcohol +   
primidone  
pristinamycin 
pristinamycin IA +  
prochloraz  
prodigiosin  
prometon  
prometryn  
propachlor  
propamidine 
propamocarb  
propan-1-ols +   
propane-2-sulfonate 
Propanoylagmatine 
propaquizafop 
propazine  
propene +   
propenol +   
propiconazole  
propranolol +   
propyl linoleate 
propynol +   
prosolanapyrone II 
prostaglandin F1alpha alcohol 
prosulfocarb 
prothioconazole  
protoasukamycin +  
protodeoxyviolaceinate 
protodeoxyviolaceinic acid 
protostemonine 
protostrychnine 
Protoveratrine A 
Protoveratrine B 
Protoverine 
proviolacein +   
Pseudocolumbamine 
pseudoephedrine 
Pseudopalmatine 
pseudopelletierine 
purine alkaloid +   
pymetrozine  
pyocyanine  
pyoverdine 
pyraclostrobin 
pyranonigrin A 
pyranonigrin E 
pyranonigrin G 
pyranonigrin H 
pyranonigrin I 
pyranonigrin J 
pyranonigrin K 
pyridine alkaloid +   
pyridinestrone-3-carboxylic acid 
pyrimethanil  
pyrocatechol sulfate 
pyrocatechol sulfate(1-) 
pyrrolidine alkaloid +   
pyrrolizidine alkaloid +   
pyrrolizine alkaloid +   
pyrrolnitrin 
quinazoline alkaloid +   
quinoline alkaloid +   
quinolizidine alkaloid +   
rac-gabaculine 
ranitidine +   
ravidomycin 
reserpine  
retinol +   
retuline 
reumycin +  
rhabduscin 
rhamnose +   
rhodopin +  
Rhoeadine 
Rhombifoline 
riddelliine N-oxide 
rifamycin SV +   
rifamycin-undecaketide carboxylic acid +  
rimsulfuron 
ristocetin 
ritonavir +   
rosaramicin 
roseoflavin 
rosuvastatin 
rotenone  
rotiorinol C 
Roxburghine B 
ryanodine  
S,S-dimethyl-beta-propiothetin 
S-(5-histidyl)cysteine sulfoxide 
S-methyl-L-ergothioneine 
saccharin +   
salinosporamide +  
Sampangine 
sarasinoside J 
sarin  
sarpagine +  
saxitoxin +   
scalusamide A 
sch 725432 
SCH51344 
schisanwilsonene A 
schizokinen 
Scholaricine 
sciscllascilloside E-1 
scoparic acid A 
scytonemin 
SD-06 
sebuthylazine 
secbumeton 
seldomycin 5 
selenoneine 
Ser-Lys 
Ser-Tyr 
sesterstatin 2 
sesterstatin 3 
Sg17-1-4 
sibiromycin 
simazine  
simeconazole 
simeton 
simulanol 
Sinactine 
sinapyl alcohol +  
sinularolide B 
sinularolide C 
sinularolide D 
sirolimus +   
sitagliptin +  
smenospongines C 
sodorifen 
solanesol  
solanidine +   
Sophoranol 
soraphen A 
sordaricin 
sotalol  
spectinabilin 
spectinomycin 
spermidine alkaloid +  
spheroiden-2-one 
sphinganine-1-phosphocholine 
spinosyn +  
spiramycin I 
spiramycin II 
spirilloxanthin +  
spironolactone  
spirosolane +   
spiroxamine  
spiruchostatin B  
spongotine A 
staphcoccomycin 
staphyloferrin A +  
staphyloferrin B 
stemofoline 
stemphyloxin I +  
stemphyloxin II 
steroid alkaloid +   
stigmatellin A  
streptidine +   
Streptococcus pneumoniae metabolite +  
streptolydigin 
streptomycin +   
streptothricin +  
streptothricin acid +  
strongylophorine-26 
strychnogucine B 
stryvomitine 
succinoglucan 
sucralose  
sulcotrione 
sulfadiazine  
sulfadimethoxine  
sulfamethazine  
sulfamethoxazole +   
sulfapyridine  
sulfathiazole +  
sulfluramid 
sulfocholine +  
syn-copalol 
syncarpamide 
synthalin A 
synthetic auxin +   
syringin 
syringolin A 
syringomycin +  
systemic acquired resistance inducing compounds 
Tabernamine 
Tabernanthine 
tabtoxinine-delta-lactam +  
tacrolimus (anhydrous) +   
tagatose 6-phosphate +  
TAMe 
taurocyamine +  
TDP-actinospectose 
TDP-actinospectose(2-) 
TDP-beta-L-rhamnose 
TDP-beta-L-rhamnose(2-) 
tebuconazole  
tebufenozide  
tebutam 
tedizolid 
teflubenzuron 
tegaserod +   
teicoplanin A2-1 +   
teicoplanin A2-2 +   
teicoplanin A2-3 +   
teicoplanin A2-4 +   
teicoplanin A2-5 +   
teicoplanin A3-1 +   
telmisartan  
Templetine 
terbumeton 
terbutryn  
terbutylazine  
terpene alkaloid +   
terpenol +   
terretonin 
tetraconazole  
tetradecan-1-ol +  
tetradecanal 
tetradecanoic-d27 acid 
tetrahydrocolumbamine 
tetrahydrofurfuryl alcohol +  
tetrahydroxysqualene 
tetramethylpyrazine  
tetrangulol +  
tetrodotoxin  
thalictricavine 
thallium(I) acetate  
Thermospine 
thiacloprid +   
thiamethoxam +   
thiazomycin 
thifensulfuron-methyl 
thiomarinol A 
thiomarinol B 
thiomarinol C 
thiomarinol D 
thiomarinol E 
thiomarinol F 
thiomarinol G 
thiopental  
Tinctorine 
tinyatoxin 
TMC-1A 
TMC-1B 
TMC-1C 
TMC-1D 
TMC-86A 
TMC-86B 
TMC-89A 
TMC-89B 
TMC-95A 
TMC-96 
tobramycin +   
toluene +   
tolybyssidin A 
tolybyssidin B 
Toxiferine I 
toxoflavin 
toyocamycin 
trabectedin  
tramadol  
trans-2,3-epoxydeca-4,6,8-triyn-1-ol 
trans-benzylideneacetone 
trehalose 6,6'-dimycolate 
trehalulose 
triacsin C  
triadimefon  
trichlopyr  
trichosetin +  
trichostatin A +   
triclocarban  
triclosan  
triethylene glycol +  
trifluralin  
trikendiol 
trimethoprim +   
trimethyltin  
trimipramine +   
trinexapac-ethyl 
triphenylmethane +   
triptobenzene A 
triptonoterpenol 
triptoquinone B 
tritosulfuron 
troleandomycin  
tropane alkaloid +   
tubercidin +   
tuberonic acid +  
tuberostemonine 
tuberostemonine N 
tunaxanthin +  
tylosin 
tyrocidine A +  
tyrocidine B +  
tyrocidine C +  
UDP-N-acetylgalactosamine-5,6-ene 
UDP-N-acetylgalactosamine-5,6-ene(2-) 
UDP-N-acetyltunicamine-uracil 
UDP-N-acetyltunicamine-uracil(2-) 
UK 63052 
UK 63598 
UK 65662 
UK-2A 
UK-2B 
UK-3A 
undecane-1,11-diol 
undecanol 
Unsaturated alcohol 
uracil octosyl acid 5'-phosphate 
uranyl hydrogenphosphate 
uremic toxin +   
uridine-5'-aldehyde 
usaramine N-oxide 
valanimycin 
validamycin A(1+) 
validamycins +  
validone +  
validoxylamine A 
validoxylamine A 7'-phosphate 
valinomycin  
valsartan +   
vancomycin +   
venlafaxine +   
venom +   
venturicidin 
veracevine 
verapamil  
veratrone +  
verongamine 
Verticine 
vibrioferrin 
vibrioferrin(3-) +  
vinervine 
Vinpocetine  
vinylamycin 
violacein  
violaceinate 
violaceinic acid 
virginiamycin 
virginiamycin S1 +  
virulence factor +   
viscosalactone B 
vladinol D 
VM 44857 
voachalotine 
VR nerve agent 
VX nerve agent  
wax ester 36:1 +  
WF14865A 
WF14865B 
withaferin A +   
withalongolide A 
withalongolide B 
withalongolide C 
withalongolide D 
withalongolide E 
withalongolide G 
Worenine 
xenobiotic organic ethers 
xestospongin C  
xylobiose 
Xylopinine 
yanuthone F +  
yanuthone I 
yanuthone L 
YTM-T 
yunaconitine 
zanamivir 
zarzissine 
zeaxanthin +  
Zephyranthine 
Zhebeinine 
zorbamycin 
Zygadenine 
zymosterol intermediate 1a 

Synonyms
Exact Synonyms: (3aS,4R,10aS)-2,6-diamino-4-(hydroxymethyl)-3a,4,8,9-tetrahydro-1H,8H-pyrrolo[1,2-c]purine-10,10-diol
Related Synonyms: 4-(hydroxymethyl)-2,6-diimino-decahydropyrrolo[1,2-c]purine-10,10-diol ;   Dcstx-saxitoxin ;   Decarbamylsaxitoxin ;   Formula=C9H16N6O3 ;   InChI=1S/C9H16N6O3/c10-6-13-5-4(3-16)12-7(11)15-2-1-8(17,18)9(5,15)14-6/h4-5,16-18H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5-,9-/m0/s1 ;   InChIKey=VRRIYZJUSNMZMP-PJPYAQQDSA-N ;   SMILES=N1C(N2[C@@]3([C@]([C@@H]1CO)(NC(N3)=N)[H])C(CC2)(O)O)=N
Xrefs: AGR:IND44454658 "Europe PMC" ;   AGR:IND601134073 "Europe PMC" ;   CAS:58911-04-9 "ChemIDplus" ;   CAS:58911-04-9 "HMDB" ;   Chemspider:28574223 ;   HMDB:HMDB0038319 ;   PMID:12740803 "Europe PMC" ;   PMID:12924931 "Europe PMC" ;   PMID:15019474 "Europe PMC" ;   PMID:15146927 "Europe PMC" ;   PMID:16192070 "Europe PMC" ;   PMID:16536478 "Europe PMC" ;   PMID:16544882 "Europe PMC" ;   PMID:17370612 "Europe PMC" ;   PMID:17996918 "Europe PMC" ;   PMID:18232710 "Europe PMC" ;   PMID:20048055 "Europe PMC" ;   PMID:20355743 "Europe PMC" ;   PMID:20650063 "Europe PMC" ;   PMID:21619049 "Europe PMC" ;   PMID:22960450 "Europe PMC" ;   PMID:24334673 "Europe PMC" ;   PMID:24418175 "Europe PMC" ;   PMID:25213823 "Europe PMC" ;   PMID:26024657 "Europe PMC" ;   Reaxys:1145725 "Reaxys"

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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.