anonymous041/ChEBI-Augmented huggingface dataset:
The molecule CCOCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1CC CCOCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1CC is an organosulfonic acid that is 2-oxoethanesulfonic acid substituted by an (ethoxymethyl)(2-ethyl-6-methylphenyl)amino group at position 2. It has the role of marine xenobiotic metabolite . It is also related to or classified as ether  . It is also related to or classified as organosulfonic acid  . It is also related to or classified as aromatic amide .
The molecule S1C=CC(=C1C(OC)=O)S(NC(=O)NC=2N=C(N=C(N2)OC)C)(=O)=O S1C=CC(=C1C(OC)=O)S(NC(=O)NC=2N=C(N=C(N2)OC)C)(=O)=O is A methyl ester resulting from the formal condensation of the carboxy group of thifensulfuron with methanol. It is used  as a post-emergence herbicide for the control of grass and broad-leaved weeds. It has the role of herbicide . It has the role of agrochemical . It has the role of xenobiotic . It has the role of environmental contaminant . Its functional parent is thifensulfuron . It is also related to or classified as methyl ester  .   It is also related to or classified as N-sulfonylurea  . It is also related to or classified as 1,3,5-triazines , thiophenes .
The molecule COCC(C)N(C(=O)C(O)=O)c1c(C)csc1C COCC(C)N(C(=O)C(O)=O)c1c(C)csc1C is A monocarboxylic acid that is oxoacetic acid substituted by a (2,4-dimethylthiophen-3-yl)(1-methoxypropan-2-yl)amino group at position 2. It is a metabolite of the herbicide dimethenamid. It has the role of marine xenobiotic metabolite .  It is also related to or classified as ether  . It is also related to or classified as monocarboxylic acid , thiophenes , aromatic amide .
The molecule COCC(C)N(C(=O)CS(O)(=O)=O)c1c(C)csc1C COCC(C)N(C(=O)CS(O)(=O)=O)c1c(C)csc1C is an organosulfonic acid that is 2-oxoethanesulfonic acid substituted by a (2,4-dimethylthiophen-3-yl)(1-methoxypropan-2-yl)amino group at position 2. It has the role of marine xenobiotic metabolite . It is also related to or classified as ether  .  It is also related to or classified as organosulfonic acid  . It is also related to or classified as thiophenes , aromatic amide .
The molecule CCc1cccc(C)c1N([C@H](C)COC)C(=O)C(O)=O CCc1cccc(C)c1N([C@H](C)COC)C(=O)C(O)=O is the (R)-enantiomer of  [(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino](oxo)acetic acid. It is also related to or classified as [(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino](oxo)acetic acid  .
The molecule CN(C)S(=O)(=O)Nc1ccccc1 CN(C)S(=O)(=O)Nc1ccccc1 is A member of the class of sulfamides that is N-phenylsulfuric diamide substituted by two methyl groups at the amino nitrogen atom. It is a metabolite of the agrochemical dichlofluanid. It has the role of marine xenobiotic metabolite . It is also related to or classified as sulfamides .
The molecule CNC(=O)Nc1ccc(Cl)c(Cl)c1 CNC(=O)Nc1ccc(Cl)c(Cl)c1 is A member of the class of phenylureas that is urea in which a hydrogens attached to one nitrogen is substituted by a methyl group, and one of the hydrogens attached to the other nitrogen is substituted by a 3,4-dichlorophenyl group. It is a metabolite of diuron. It has the role of marine xenobiotic metabolite . It is also related to or classified as a 1-methyl-3-phenylurea  . It is also related to or classified as dichlorobenzene  . It is also related to or classified as phenylureas .
The molecule NC(=O)Nc1ccc(Cl)c(Cl)c1 NC(=O)Nc1ccc(Cl)c(Cl)c1 is A member of the class of ureas that is urea substituted by a 3,4-dichlorophenyl group at position 1. It is a metabolite of the herbicide diuron. It has the role of marine xenobiotic metabolite .  It is also related to or classified as dichlorobenzene  . It is also related to or classified as phenylureas .
The molecule CNC(=O)Nc1ccc(cc1)C(C)C CNC(=O)Nc1ccc(cc1)C(C)C is A member of the class of phenylureas that is 1-methylurea substituted by a p-cumenyl group at position 3. It is a metabolite of the herbicide isoproturon. It has the role of marine xenobiotic metabolite . It is also related to or classified as a 1-methyl-3-phenylurea  . It is also related to or classified as phenylureas .
The molecule CCc1cccc(C)c1N([C@@H](C)COC)C(=O)C(O)=O CCc1cccc(C)c1N([C@@H](C)COC)C(=O)C(O)=O is the (S)-enantiomer of  [(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino](oxo)acetic acid. It is also related to or classified as [(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino](oxo)acetic acid  .
The molecule CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1 CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1 is an  aromatic ketone that is cyclohexane-1,3-dione substituted by a 2-chloro-4-(methylsulfonyl)benzoyl group at position 2. It has the role of carotenoid biosynthesis inhibitor . It has the role of herbicide . It has the role of xenobiotic . It has the role of environmental contaminant .   It is also related to or classified as sulfone  . It is also related to or classified as beta-triketone , cyclohexanones , aromatic ketone .
The molecule CC(C)Nc1nc(N)nc(O)n1 CC(C)Nc1nc(N)nc(O)n1 is A diamino-1,3,5-triazine that is N-(propan-2-yl)-1,3,5-triazine-2,4-diamine substituted by a hydroxy group at position 2. It is a metabolite of the herbicide atrazine. It has the role of marine xenobiotic metabolite . It is also related to or classified as diamino-1,3,5-triazine , heteroaryl hydroxy compound .
The molecule CCc1cccc(C)c1N([C@@H](C)COC)C(=O)CS(O)(=O)=O CCc1cccc(C)c1N([C@@H](C)COC)C(=O)CS(O)(=O)=O is the (S)-enantiomer of  2-[(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid. It is also related to or classified as 2-[(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid  .
The molecule CCNc1nc(O)nc(NC(C)(C)C)n1 CCNc1nc(O)nc(NC(C)(C)C)n1 is A diamino-1,3,5-triazine that is 1,3,5-triazin-2-ol substituted by a tert-butylamino group at position 4 and an ethylamino group at position 6. It is a metabolite of the herbicide terbutylazine,. It has the role of marine xenobiotic metabolite . It is also related to or classified as diamino-1,3,5-triazine , heteroaryl hydroxy compound .
The molecule CN(C)S(=O)(=O)Nc1ccc(C)cc1 CN(C)S(=O)(=O)Nc1ccc(C)cc1 is A member of the class of  sulfamides that is N,N-dimethylsulfuric diamide substituted by a 4-methylphenyl group at the amino nitrogen atom. It is a metabolite of the agrochemical tolylfluanid. It has the role of marine xenobiotic metabolite . It is also related to or classified as sulfamides .
The molecule CC(C)N(C(=O)C(O)=O)c1ccc(F)cc1 CC(C)N(C(=O)C(O)=O)c1ccc(F)cc1 is A monocarboxylic acid that is oxoacetic acid substituted by a (4-fluorophenyl)(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide flufenacet.   It is also related to or classified as monofluorobenzenes  . It is also related to or classified as monocarboxylic acid , aromatic amide .
The molecule CC(C)N(C(=O)CS(O)(=O)=O)c1ccc(F)cc1 CC(C)N(C(=O)CS(O)(=O)=O)c1ccc(F)cc1 is an  organosulfonic acid that is 2-oxoethanesulfonic acid substituted by a (4-fluorophenyl)(propan-2-yl)amino group at position 2. It is metabolite of the herbicide flufenacet. It has the role of marine xenobiotic metabolite . It is also related to or classified as organosulfonic acid  .  It is also related to or classified as monofluorobenzenes  . It is also related to or classified as aromatic amide .
The molecule CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O CC(C)(Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1)C(O)=O is A monocarboxylic acid that is 2-methylpropanoic acid substituted by a 4-(4-chlorobenzoyl)phenoxy group at position 2. It is a metabolite of the drug fenofibrate. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite . It is also related to or classified as chlorobenzophenone , monocarboxylic acid , aromatic ketone .
The molecule CC(C)NCC(O)COc1ccc(CC(O)=O)cc1 CC(C)NCC(O)COc1ccc(CC(O)=O)cc1 is A monocarboxylic acid that is phenylacetic acid substituted by a 2-hydroxy-3-(propan-2-ylamino)propoxy group at position 4. It is a metabolite of the drug atenolol. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite .   It is also related to or classified as secondary alcohol  . It is also related to or classified as monocarboxylic acid , aromatic ether , secondary amino compound .
The molecule CCc1cccc(C)c1N([C@H](C)COC)C(=O)CS(O)(=O)=O CCc1cccc(C)c1N([C@H](C)COC)C(=O)CS(O)(=O)=O is the (R)-enantiomer of  2-[(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid. It is also related to or classified as 2-[(2-ethyl-6-methylphenyl)(1-methoxypropan-2-yl)amino]-2-oxoethanesulfonic acid  .
The molecule Nc1cnnc(O)c1Cl Nc1cnnc(O)c1Cl is A heteroaryl hydroxy compound that is pyridazin-3-ol substituted by an amino group at position 5 and a chloro group at position 4. It is a metabolite of the herbicide chloridazone. It has the role of marine xenobiotic metabolite . It is also related to or classified as organochlorine compound  .  It is also related to or classified as primary arylamine  . It is also related to or classified as pyridazines , heteroaryl hydroxy compound .
The molecule CC(C)(C)Nc1nc(N)nc(O)n1 CC(C)(C)Nc1nc(N)nc(O)n1 is A diamino-1,3,5-triazine that is 1,3,5-triazin-2-ol substituted by an amino group at position 4 and a tert-butylamino group at position 6. It is metabolite of the herbicide terbutylazine. It has the role of marine xenobiotic metabolite . It is also related to or classified as diamino-1,3,5-triazine , heteroaryl hydroxy compound .
The molecule OC(=O)C(C1CCCCN1)c1ccccc1 OC(=O)C(C1CCCCN1)c1ccccc1 is A monocarboxylic acid that is phenylacetic acid substituted by a piperidin-2-yl group at position 2. It is a metabolite of the drug methylphenidate. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite . It is also related to or classified as monocarboxylic acid , piperidines .
The molecule COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)n1 COc1cc(OC)nc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)n1 is A sulfonamide that is benzenesulfonamide substituted by an acetylamino group at position 4 and a 4,6-dimethoxy-pyrimidin-2-yl group at the nitrogen atom. It is a metabolite of the sulfonamide antibiotic sulfadimethoxine. It has the role of marine xenobiotic metabolite .  It is also related to or classified as sulfonamide  . It is also related to or classified as acetamides , pyrimidines .
The molecule OC[C@H]1OC(n2ccc(=O)[nH]c2=O)C(F)(F)[C@@H]1O OC[C@H]1OC(n2ccc(=O)[nH]c2=O)C(F)(F)[C@@H]1O is A pyrimidine 2'-deoxyribonucleoside that is uridine in which the hydroxy group at position 2' has been replaced by two fluoro substituents. It is a metabolite of the drug gemcitabine. It has the role of marine xenobiotic metabolite .  It is also related to or classified as organofluorine compound  . It is also related to or classified as pyrimidine 2'-deoxyribonucleoside .
The molecule CC(C)N(C(=O)CS(O)(=O)=O)c1ccccc1 CC(C)N(C(=O)CS(O)(=O)=O)c1ccccc1 is an organosulfonic acid that is 2-oxoethanesulfonic acid substituted by a phenyl(propan-2-yl)amino group at position 2. It is a metabolite of the herbicide propachlor. It has the role of marine xenobiotic metabolite . It is also related to or classified as anilide  . It is also related to or classified as organosulfonic acid  .
The molecule Nc1c(SC(F)(F)F)c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N Nc1c(SC(F)(F)F)c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N is A member of the class of pyrazoles that is 1H-pyrazole that is substituted at positions 1, 3, 4, and 5 by 2,6-dichloro-4-(trifluoromethyl)phenyl, cyano, (trifluoromethyl)sulfanyl, and amino groups, respectively. It is a metabolite of the agrochemical fipronil. It has the role of marine xenobiotic metabolite . It is also related to or classified as organic sulfide  . It is also related to or classified as nitrile  . It is also related to or classified as dichlorobenzene  . It is also related to or classified as pyrazoles , (trifluoromethyl)benzenes .
The molecule Cc1cccc(C)c1N(Cn1cccn1)C(=O)CS(O)(=O)=O Cc1cccc(C)c1N(Cn1cccn1)C(=O)CS(O)(=O)=O is an organosulfonic acid that is 2-oxoethanesulfonic acid substituted by a (2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino group at position 2. It is metabolite of the herbicide metazachlor. It has the role of marine xenobiotic metabolite .  It is also related to or classified as organosulfonic acid  . It is also related to or classified as pyrazoles , aromatic amide .
The molecule COCCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1C COCCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1C is an  organosulfonic acid that is 2-oxoethanesulfonic acid substituted by a (2,6-dimethylphenyl)(2-methoxyethyl)amino group at position 2. It is a metabolite of the herbicide dimethachlor. It has the role of marine xenobiotic metabolite . It is also related to or classified as ether  . It is also related to or classified as organosulfonic acid  . It is also related to or classified as aromatic amide .
The molecule C(C(C(C(C(O)=O)(F)F)(F)F)(F)F)(F)(F)F C(C(C(C(C(O)=O)(F)F)(F)F)(F)F)(F)(F)F is A monocarboxylic acid that is perfluorinated pentanoic acid. It has the role of xenobiotic . It has the role of environmental contaminant . Its functional parent is valeric acid . It is also related to or classified as fluoroalkanoic acid .
The molecule COCCN(C(=O)C(O)=O)c1c(C)cccc1C COCCN(C(=O)C(O)=O)c1c(C)cccc1C is A monocarboxylic acid that is oxoacetic acid substituted by a (2,6-dimethylphenyl)(2-methoxyethyl)amino group at position 2. It has the role of marine xenobiotic metabolite .  It is also related to or classified as ether  . It is also related to or classified as monocarboxylic acid , aromatic amide .
The molecule CN[C@H]1[C@@H](C)O[C@@H](O[C@@H]2[C@@H](O)c3cc4C(=O)c5c(O)cc(OC)cc5C(=O)c4c(O)c3-c3c(O)c(C(=O)N[C@H](C)C(O)=O)c(C)cc23)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O CN[C@H]1[C@@H](C)O[C@@H](O[C@@H]2[C@@H](O)c3cc4C(=O)c5c(O)cc(OC)cc5C(=O)c4c(O)c3-c3c(O)c(C(=O)N[C@H](C)C(O)=O)c(C)cc23)[C@H](O)[C@H]1O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O is A member of the class of pradimicins that is isolated from the cultured broth of Actinomadura hibisca No. P157-2 (ATCC 53557). Its functional parent is D-alanine .   It is also related to or classified as carboxylic acid  .  It is also related to or classified as secondary alcohol  . It is also related to or classified as p-quinones , polyphenol , aromatic ether , disaccharide derivative , pradimicin , L-alanine derivative .
The molecule CCNc1nc(O)nc(NCC)n1 CCNc1nc(O)nc(NCC)n1 is A diamino-1,3,5-triazine that is N,N'-diethyl-1,3,5-triazine-2,4-diamine substituted by a hydroxy group at position 2. It is a metabolite of the herbicide simazine. It has the role of marine xenobiotic metabolite . It is also related to or classified as diamino-1,3,5-triazine , heteroaryl hydroxy compound .
The molecule Cn1ncc(N)c(Cl)c1=O Cn1ncc(N)c(Cl)c1=O is A pyridazinone that is pyridazin-3(2H)-one substituted by an amino group at position 5, a chloro group at position 4 and a methyl group at position 2. It is a metabolite of the herbicide chloridazone.jfuyklriltoil. It has the role of marine xenobiotic metabolite .  It is also related to or classified as organochlorine compound  . It is also related to or classified as primary arylamine  . It is also related to or classified as pyridazinone .
The molecule Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)C(F)(F)F Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)C(F)(F)F is A member of the class of pyrazoles that is 1H-pyrazole that is substituted at positions 1, 3, 4, and 5 by 2,6-dichloro-4-(trifluoromethyl)phenyl, cyano, trifluoromethyl, and amino groups, respectively. It has the role of marine xenobiotic metabolite . It is also related to or classified as nitrile  . It is also related to or classified as dichlorobenzene  . It is also related to or classified as pyrazoles , (trifluoromethyl)benzenes .
The molecule OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A fluoroalkanoic acid that is perfluorinated undecanoic acid. It has the role of xenobiotic . It has the role of environmental contaminant . Its functional parent is undecanoic acid . It is also related to or classified as fluoroalkanoic acid .
The molecule CNC(NCCSCc1ccc(CN(C)(C)=O)o1)=C[N+]([O-])=O CNC(NCCSCc1ccc(CN(C)(C)=O)o1)=C[N+]([O-])=O is A N-oxide derivative of ranitidine. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite .  It is also related to or classified as N-oxide  . It is also related to or classified as furans , C-nitro compound .
The molecule Cc1cccc(C)c1N(Cn1cccn1)C(=O)C(O)=O Cc1cccc(C)c1N(Cn1cccn1)C(=O)C(O)=O is A monocarboxylic acid that is oxoacetic acid substituted by a (2,6-dimethylphenyl)(1H-pyrazol-1-ylmethyl)amino group at position 2. It is metabolite of the herbicide metazachlor. It has the role of marine xenobiotic metabolite . It is also related to or classified as monocarboxylic acid , pyrazoles , aromatic amide .
The molecule Nc1nc(=O)n(cc1CO)[C@H]1C[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)O1 Nc1nc(=O)n(cc1CO)[C@H]1C[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)O1 is A pyrimidine 2'-deoxyribonucleoside 5'-diphosphate that is 2'-deoxycytidine 5'-diphosphate (CDP) substituted by a hydroxymethyl group at position 5. Its functional parent is CDP . It is also related to or classified as pyrimidine 2'-deoxyribonucleoside 5'-diphosphate .
The molecule OC(=O)C=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F OC(=O)C=C(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A fluorotelomer that is dec-2-enoic acid substituted by fluoro groups at positions 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8, 9, 9, 10, 10 and 10 respectively. It has the role of xenobiotic . It has the role of persistent organic pollutant . It is also related to or classified as alpha,beta-unsaturated monocarboxylic acid , fluorotelomer .
The molecule C(C(C(F)(F)F)(F)F)(C(C(C(=C(C(O)=O)[H])F)(F)F)(F)F)(F)F C(C(C(F)(F)F)(F)F)(C(C(C(=C(C(O)=O)[H])F)(F)F)(F)F)(F)F is A fluorotelomer that is oct-2-enoic acid substituted by fluoro groups at positions 3, 4, 4, 5, 5,6, 6, 7, 7, 8, 8 and 8 respectively. It has the role of xenobiotic . It has the role of persistent organic pollutant . It is also related to or classified as alpha,beta-unsaturated monocarboxylic acid , fluorotelomer .
The molecule CO\C=C(\C(O)=O)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1 CO\C=C(\C(O)=O)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1 is an aryloxypyrimidine having a 4,6-diphenoxypyrimidine skeleton in which one of the phenyl rings is cyano-substituted at C-2 and the other carries a 1-carboxy-2-methoxyethenyl substituent, also at C-2. It is a metabolite of the fungicidal agrochemical azoxystrobin. It has the role of marine xenobiotic metabolite . It is also related to or classified as nitrile  . It is also related to or classified as enol ether  . It is also related to or classified as aryloxypyrimidine , aromatic ether .
The molecule OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A monocarboxylic acid that is perfluorinated hexanoic acid. It has the role of xenobiotic . It has the role of environmental contaminant . Its functional parent is hexanoic acid . It is also related to or classified as fluoroalkanoic acid .
The molecule Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)(=O)C(F)(F)F Nc1c(c(nn1-c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)(=O)C(F)(F)F is A member of the class of pyrazoles that is 1H-pyrazole that is substituted at positions 1, 3, 4, and 5 by 2,6-dichloro-4-(trifluoromethyl)phenyl, cyano, (trifluoromethyl)sulfonyl, and amino groups, respectively. It is a metabolite of the agrochemical fipronil. It has the role of marine xenobiotic metabolite . It is also related to or classified as nitrile  . It is also related to or classified as dichlorobenzene  .  It is also related to or classified as sulfone  . It is also related to or classified as pyrazoles , (trifluoromethyl)benzenes .
The molecule OC(=O)C(N1CCc2sccc2C1)c1ccccc1Cl OC(=O)C(N1CCc2sccc2C1)c1ccccc1Cl is A thienopyridine that is 6,7-dihydrothieno[3,2-c]pyridin-5(4H)-ylacetic acid substituted by a 2-chlorophenyl group at position 2. It is a metabolite of the drug  clopidogrel. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite . It is also related to or classified as monocarboxylic acid , thienopyridine , tertiary amino compound , monochlorobenzenes .
The molecule COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NCCC(C)(C)C COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NCCC(C)(C)C is A dipeptide composed of N-(3,3-dimethylbutyl)-L-aspartic acid and methyl L-phenylalanate units joined by a peptide linkage. It has the role of xenobiotic . It has the role of sweetening agent . It has the role of environmental contaminant . It is also related to or classified as dipeptide  .
The molecule CN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F CN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A sulfonamide that is the N-methyl derivative of perfluorooctane sulfonamidoacetic acid. It has the role of xenobiotic . It has the role of environmental contaminant .  It is also related to or classified as sulfonamide  . It is also related to or classified as organofluorine compound  . It is also related to or classified as monocarboxylic acid .
The molecule CCN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F CCN(CC(O)=O)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A sulfonamide that is the N-ethyl derivative of perfluorooctane sulfonamidoacetic acid. It has the role of xenobiotic . It has the role of environmental contaminant .  It is also related to or classified as sulfonamide  . It is also related to or classified as organofluorine compound  . It is also related to or classified as monocarboxylic acid .
The molecule OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F OP(O)(=O)OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F is A monoalkyl phosphate that is 3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-1-ol in which the hydroxyl hydrogen is substituted by a phosphate group. It has the role of xenobiotic . It has the role of environmental contaminant .  It is also related to or classified as organofluorine compound  . It is also related to or classified as monoalkyl phosphate .
The molecule CCc1cccc(C)c1N1C(C)COCC1=O CCc1cccc(C)c1N1C(C)COCC1=O is A member of the class of  morpholines that is morpholin-3-one substituted by a 2-ethyl-6-methylphenyl group at position 4 and a methyl group at position 5. It is a metabolite of metolachlor. It has the role of marine xenobiotic metabolite .  It is also related to or classified as delta-lactam  . It is also related to or classified as morpholines .
The molecule COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2cc(NC=O)ccc2C(=O)N(C)C)n1 COc1cc(OC)nc(NC(=O)NS(=O)(=O)c2cc(NC=O)ccc2C(=O)N(C)C)n1 is A member of the class of  benzamides that is N,N-dimethylbenzamide substituted by a formylamino group at position 4 and a [(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamoyl group at position 2. It has the role of herbicide . It has the role of xenobiotic . It has the role of environmental contaminant .  It is also related to or classified as sulfonamide  . It is also related to or classified as benzamides , aromatic ether , pyrimidines , ureas .
The molecule CC1(C)C(=O)Oc2ccc(OS(C)(=O)=O)cc12 CC1(C)C(=O)Oc2ccc(OS(C)(=O)=O)cc12 is A methanesulfonate ester that is methanesulfonic acid in which the hydrogen of the hydroxy group has been replaced by a 3,3-dimethyl-2-oxo-2,3-dihydro-1-benzofuran-5-yl group. It is a metabolite of the herbicide ethofumesate. It has the role of marine xenobiotic metabolite . It is also related to or classified as methanesulfonate ester  . It is also related to or classified as gamma-lactone  . It is also related to or classified as 1-benzofurans .
The molecule CNC(NCCS(=O)Cc1ccc(CN(C)C)o1)=C[N+]([O-])=O CNC(NCCS(=O)Cc1ccc(CN(C)C)o1)=C[N+]([O-])=O is A sulfoxide derivative of the drug ranitidine. It has the role of drug metabolite . It has the role of marine xenobiotic metabolite . It is also related to or classified as sulfoxide  . It is also related to or classified as furans , C-nitro compound , tertiary amino compound .