anonymous041/ChEBI-Augmented huggingface dataset:
The molecule CCCC(S)CCO CCCC(S)CCO is an alkanethiol that is hexane substituted at positions 1 and 3 by hydroxy and sulfanyl groups respectively. It has the role of flavouring agent . It has the role of Saccharomyces cerevisiae metabolite . It has the role of plant metabolite . It is also related to or classified as primary alcohol  . It is also related to or classified as alkanethiol  .
The molecule CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)OC(=O)CCCCCCC\C=C/CCCCCCCC is A triacyl-sn-glycerol in which the acyl groups at positions 1 and 2 are specified as oleoyl while that at position 3 is specifed as linoleoyl. It has the role of mouse metabolite . Its functional parent is oleic acid . Its functional parent is linoleic acid . It is also related to or classified as 1,2-diacyl-3-linoleoylglycerol  . It is also related to or classified as triacyl-sn-glycerol  . It is also related to or classified as linoleoyl containing 1,2,3-triacyl-sn-glycerol  .
The molecule CCCCCCCCCCCCCCCCOC[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)OC(C)=O CCCCCCCCCCCCCCCCOC[C@H](COC(=O)CCCCCCC\C=C/C\C=C/CCCCC)OC(C)=O is A 1-alkyl-2-acetyl-3-acyl-sn-glycerol in which the alkyl and acyl groups are specified as palmityl and linoleoyl. Its functional parent is linoleic acid . Its functional parent is 1-O-palmityl-2-acetyl-sn-glycerol . It is also related to or classified as 1-alkyl-2-acetyl-3-acyl-sn-glycerol  .
The molecule CCCCCCCCCCCCCCCCO[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C CCCCCCCCCCCCCCCCO[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C is A 1-acyl-2-alkyl-sn-glycero-3-phosphocholine in which the acyl and alkyl groups at positions 1 and 2 are specified respectively as arachidonoyl and palmityl. It is also related to or classified as arachidonic acid  . It is also related to or classified as 1-acyl-2-alkyl-sn-glycero-3-phosphocholine  .
The molecule CC[C@H](CO)\C=C(\C)[C@H]1C[C@@H](C[C@@H](O)C(C)(C)[C@]2(O)O[C@@H](C[C@H](OC)[C@@H]2O)C[C@H](OC)[C@@H](O)C(=O)O1)OC CC[C@H](CO)\C=C(\C)[C@H]1C[C@@H](C[C@@H](O)C(C)(C)[C@]2(O)O[C@@H](C[C@H](OC)[C@@H]2O)C[C@H](OC)[C@@H](O)C(=O)O1)OC is A macrolide that is a novel secondary metabolite isolated from a New Zealand marine sponge, Mycale hentscheli. It has the role of antineoplastic agent . It has the role of microtubule-stabilising agent . It has the role of antimitotic . It has the role of marine metabolite . It is also related to or classified as primary alcohol  . It is also related to or classified as macrolide  . It is also related to or classified as ether  .  It is also related to or classified as secondary alcohol  . It is also related to or classified as organic heterobicyclic compound , cyclic hemiketal .
The molecule Clc1ccc(CO\N=C(/Cn2cc[nH+]c2)c2ccc(Cl)cc2Cl)c(Cl)c1 Clc1ccc(CO\N=C(/Cn2cc[nH+]c2)c2ccc(Cl)cc2Cl)c(Cl)c1 is an imidazolium ion resulting from the protonation of the imidazole ring of oxiconazole. It is a conjugate acid of oxiconazole . It is also related to or classified as imidazolium ion .
The molecule C[N+]([O-])=O C[N+]([O-])=O is A primary nitroalkane that is methane in which one of the hydrogens is replace by a nitro group. A polar solvent (b.p. 101 degreeC), it is an important starting material in organic synthesis. It is also used as a fuel for rockets and radio-controlled models. It has the role of NMR chemical shift reference compound . It has the role of polar aprotic solvent . It has the role of explosive . It has the role of EC 4.3.1.3 (histidine ammonia-lyase) inhibitor . It is also related to or classified as primary nitroalkane  . It is also related to or classified as volatile organic compound .
The molecule CC(=O)N[C@@H](C(O)=O)C(C)(C)SN=O CC(=O)N[C@@H](C(O)=O)C(C)(C)SN=O is A nitroso compound that is N-acetyl-D-penicillamine in which the sulfanyl hydrogen is replaced by a nitroso group. It has the role of vasodilator agent . It has the role of nitric oxide donor . Its functional parent is N-acetyl-D-penicillamine . It is also related to or classified as nitrosothio compound  . It is also related to or classified as nitroso compound .
The molecule COC=O COC=O is A formate ester resulting from the formal condensation of formic acid with methanol. A low-boiling (31.5 degreeC) colourless, flammable liquid, it has been used as a fumigant and larvicide for tobacco and food crops. It has the role of insecticide . It has the role of fumigant . It has the role of polar aprotic solvent . It has the role of refrigerant . Its functional parent is methanol .  It is also related to or classified as methyl ester  . It is also related to or classified as volatile organic compound , formate ester .
The molecule CCN(CC)N(O)N=O CCN(CC)N(O)N=O is A nitroso compound that is triazane in which the the nitrogen at position 1 is substituted by two ethyl groups, that at position 2 is substituted by a hydroxy group, and that at position 3 is substituted by an oxo group. It has the role of nitric oxide donor . It is a conjugate acid of NONOate(1-) . It is also related to or classified as nitroso compound , tertiary amino compound .
The molecule CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCC)COP([O-])(=O)OCC[N+](C)(C)C is A 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups at position 1 and 2 are specified as arachidonoyl and palmitoyl respectively. Its functional parent is hexadecanoic acid . Its functional parent is arachidonic acid . It is also related to or classified as phosphatidylcholine (20:4/16:0)  . It is also related to or classified as 1,2-diacyl-sn-glycero-3-phosphocholine  .
The molecule Cc1cc(c(O)c(C)c1CC1=[NH+]CCN1)C(C)(C)C Cc1cc(c(O)c(C)c1CC1=[NH+]CCN1)C(C)(C)C is A carboxamidinium ion resulting from the protonation of the carboxamidine group of oxymetazoline. It is the major species at pH 7.3. It is a conjugate acid of oxymetazoline . It is also related to or classified as carboxamidinium ion .
The molecule CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC is A phosphatidylcholine 36:2 in which the acyl groups positions 1 and 2 are specified as octadecanoyl and (9Z,12Z)-octadecadienoyl respectively. It has the role of mouse metabolite . Its functional parent is linoleic acid . Its functional parent is octadecanoic acid . It is also related to or classified as phosphatidylcholine 36:2  .
The molecule CCCCCCCCCC(=O)OC[C@@H](O)COP([O-])([O-])=O CCCCCCCCCC(=O)OC[C@@H](O)COP([O-])([O-])=O is A 1-acyl-sn-glycerol 3-phosphate(2-) obtained by deprotonation of the phosphate OH groups of 1-capryl-sn-glycero-3-phosphate. It is also related to or classified as 1-acyl-sn-glycerol 3-phosphate(2-)  .
The molecule CCN(CC)N([O-])N=O CCN(CC)N([O-])N=O is an organic anion that is the conjugate base of 1,1-diethyl-2-hydroxy-3-oxotriazane, obtained by deprotonation of the N-hydroxy group. It is also related to or classified as organic anion .
The molecule [Na+].O[As](O)([O-])=O [Na+].O[As](O)([O-])=O is an inorganic sodium salt that is the monosodium salt of arsenic acid. It has the role of carcinogenic agent . It is also related to or classified as inorganic sodium salt .
The molecule C(CCCCCC)CCC(=O)OC[C@H](COP(O)(=O)O)O C(CCCCCC)CCC(=O)OC[C@H](COP(O)(=O)O)O is A 1-acyl-sn-glycerol 3-phosphate in which the 1-acyl substituent is specified as decanoyl. It is a conjugate acid of 1-decanoyl-sn-glycero-3-phosphate(2-) . It is also related to or classified as 1-acyl-sn-glycerol 3-phosphate  . It is also related to or classified as decanoate ester  .
The molecule CCCCCCCCCCCCCCCCO[C@H](CO)COP([O-])(=O)OCC[N+](C)(C)C CCCCCCCCCCCCCCCCO[C@H](CO)COP([O-])(=O)OCC[N+](C)(C)C is A 2-alkyl-sn-glycero-3-phosphocholine in which the alkyl group is specified as hexadecyl. It is also related to or classified as 2-alkyl-sn-glycero-3-phosphocholine  .
The molecule CN(C)CCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1 CN(C)CCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1 is A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 5-(dimethylamino)pentanoic acid with the aromatic amino group of N-[(4-aminophenyl)carbamothioyl]-4-tert-butylbenzamide. It has the role of antineoplastic agent . It has the role of Sir2 inhibitor . It has the role of p53 activator . It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as tertiary amino compound , thioureas .
The molecule Clc1ccc(CO\N=C(/Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 Clc1ccc(CO\N=C(/Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1 is an oxime O-ether that is the 2,4-dichlorobenzyl ether of the oxime obtained by formal condensation of hydroxylamine with the carbonyl group of acetopnenone in which the phenyl group is substituted by chlorines at positions 2 and 4, and in which one of the hydrogens of the methyl group is replaced by a 1H-imidazol-1-yl group. An antifungal agent, it is used (generally as the nitrate salt) in creams and powders for the topical treatment of fungal skin infections. It has the role of antiinfective agent . It is also related to or classified as dichlorobenzene  . It is also related to or classified as oxime O-ether  . It is also related to or classified as imidazole antifungal drug , conazole antifungal drug , imidazoles .
The molecule COC(C)=O COC(C)=O is an acetate ester resulting from the formal condensation of acetic acid with methanol. A low-boiling (57 degreeC) colourless, flammable liquid, it is used as a solvent for many resins and oils. It has the role of fragrance . It has the role of polar aprotic solvent . It has the role of EC 3.4.19.3 (pyroglutamyl-peptidase I) inhibitor .  It is also related to or classified as methyl ester  . It is also related to or classified as acetate ester  . It is also related to or classified as volatile organic compound .
The molecule Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C Cc1cc(c(O)c(C)c1CC1=NCCN1)C(C)(C)C is A member of the class of phenols that is 2,4-dimethylphenol which is substituted at positions 3 and 6 by 4,5-dihydro-1H-imidazol-2-ylmethyl and tert-butyl groups, respectively. A direct-acting sympathomimetic with marked alpha-adrenergic activity, it is a vasoconstrictor that is used (generally as the hydrochloride salt) to relieve nasal congestion. It has the role of sympathomimetic agent . It has the role of alpha-adrenergic agonist . It has the role of vasoconstrictor agent . It has the role of nasal decongestant . It is also related to or classified as phenols  . It is also related to or classified as carboxamidine  . It is also related to or classified as imidazolines .
The molecule CC[C@@H](O)C[C@H]1CCC[C@@]2(C[C@@H]3OC(=O)\C=C\[C@@](C)(O)[C@@H](O)[C@H](C)[C@@H](O)[C@H](O[C@H]4CC[C@@H]([C@H](C)O4)N(C)C)[C@@H](O)[C@](C)(O)CCCCC\C=C\[C@@H]4CC(C)(C)O[C@@]4(O)C[C@H](O2)[C@H]3C)O1 CC[C@@H](O)C[C@H]1CCC[C@@]2(C[C@@H]3OC(=O)\C=C\[C@@](C)(O)[C@@H](O)[C@H](C)[C@@H](O)[C@H](O[C@H]4CC[C@@H]([C@H](C)O4)N(C)C)[C@@H](O)[C@](C)(O)CCCCC\C=C\[C@@H]4CC(C)(C)O[C@@]4(O)C[C@H](O2)[C@H]3C)O1 is A  macrolide antibiotic that was originally isolated from the culture broths of Streptomyces hygroscopicus var. ossamyceticus. It has the role of antineoplastic agent . It has the role of bacterial metabolite .  It is also related to or classified as tertiary alcohol  . It is also related to or classified as secondary alcohol  . It is also related to or classified as macrolide antibiotic , organic heterotetracyclic compound , cyclic hemiketal , spiroketal .
The molecule CCNCC.CCN(CC)N(O)N=O CCNCC.CCN(CC)N(O)N=O is an organoammonium salt that is the diethylammonium salt of 1,1-diethyl-2-hydroxy-3-oxotriazane. It has the role of nitric oxide donor . It is also related to or classified as organoammonium salt .
The molecule CCCCCCCCCC(=O)OC[C@@H](O)COP([O-])(=O)OCC[N+](C)(C)C CCCCCCCCCC(=O)OC[C@@H](O)COP([O-])(=O)OCC[N+](C)(C)C is A 1-O-acyl-sn-glycero-3-phosphocholine in which the acyl group is specified as capryl (decanoyl). It is also related to or classified as 1-O-acyl-sn-glycero-3-phosphocholine  . It is also related to or classified as decanoate ester  .
The molecule COc1ccc(cc1)-c1coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c1=O COc1ccc(cc1)-c1coc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2c1=O is A 4'-methoxyisoflavone that is formononetin attached to a beta-D-glucopyranosyl moiety at position 7 via a glycosidic linkage. It has the role of plant metabolite . Its functional parent is formononetin . It is also related to or classified as 4'-methoxyisoflavones  . It is also related to or classified as 7-hydroxyisoflavones 7-O-beta-D-glucoside  . It is also related to or classified as monosaccharide derivative .
The molecule N#CC(C1=CC=C(OC)C(OC)=C1)(CCC[NH+](C)CCC2=CC=C(OC)C(OC)=C2)C(C)C N#CC(C1=CC=C(OC)C(OC)=C1)(CCC[NH+](C)CCC2=CC=C(OC)C(OC)=C2)C(C)C is an ammonium ion resulting from the protonation of the tertiary amino group of (S)-verapamil. It is a conjugate acid of (S)-verapamil . It is also related to or classified as ammonium ion derivative .
The molecule [Cd++].[O-][N+]([O-])=O.[O-][N+]([O-])=O [Cd++].[O-][N+]([O-])=O.[O-][N+]([O-])=O is an inorganic nitrate salt having Cd(2+) as the counterion. It has the role of genotoxin . It has the role of carcinogenic agent . It has the role of hepatotoxic agent . It is also related to or classified as cadmium salt , inorganic nitrate salt .
The molecule COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC is A tertiary amino compound that is 3,4-dimethoxyphenylethylamine in which the hydrogens attached to the nitrogen are replaced by a methyl group and a 4-cyano-4-(3,4-dimethoxyphenyl)-5-methylhexyl group. It is also related to or classified as nitrile  .  It is also related to or classified as polyether  . It is also related to or classified as aromatic ether , tertiary amino compound .
The molecule CCCCCCC\C=C\C(CCCCCCCC(O)=O)OO CCCCCCC\C=C\C(CCCCCCCC(O)=O)OO is A hydroperoxy fatty acid that is 9-hydroperoxy derivative of (10E)-octadecenoic acid. Its functional parent is oleic acid . It is a conjugate acid of 9-hydroperoxy-10E-octadecenoate . It is also related to or classified as hydroperoxyoctadecenoic acid .
The molecule COc1ccc(CCN(C)CCC[C@@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC COc1ccc(CCN(C)CCC[C@@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC is A 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile that has R configuration. It competitively inhibits the multidrug resistance efflux pump P-glycoprotein (MDR-1, EC 3.6.3.44), thereby potentially increasing the effectiveness of a wide range of antineoplastic drugs which are inactivated by MDR-1 mechanisms. Dexverapamil exhibits lower calcium antagonistic activity and toxicity than racemic verapamil. It has the role of EC 3.6.3.44 (xenobiotic-transporting ATPase) inhibitor . It is also related to or classified as 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile  .
The molecule CC(C)(C)c1[nH]c2c(cc(cc2c1C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCc1ccccc1)C(C)(C)C)C(C)(C)C CC(C)(C)c1[nH]c2c(cc(cc2c1C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCc1ccccc1)C(C)(C)C)C(C)(C)C is A tripeptide that is the 2-phenylethyl amide of L-arginyl-2,5,7-tri-tert-butyl-L-tryptophyl-L-arginine. It has the role of antimicrobial agent . It has the role of peptidomimetic . It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as tripeptide  .
The molecule [H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCC\C=C\C(CCCCCCCC)OO [H][C@@](COC(=O)CCCCCCCCCCCCCCC)(COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCC\C=C\C(CCCCCCCC)OO is is_a_ CHEBI:64517 in which 1 and 2-acyl groups are specified as hexadecanoyl and 10-hydroperoxy 8E-octadecenoyl respectively. It is also related to or classified as organic molecular entity .
The molecule c1[nH+][nH]c2ccccc12.Cl[Ru-3](Cl)(Cl)(Cl)([n+]1cc2ccccc2[nH]1)[n+]1cc2ccccc2[nH]1 c1[nH+][nH]c2ccccc12.Cl[Ru-3](Cl)(Cl)(Cl)([n+]1cc2ccccc2[nH]1)[n+]1cc2ccccc2[nH]1 is A ruthenium coordination entity that is the indazolium salt of tetrachloro[bis(1H-indazole-kappaN(2))]ruthenate. It has the role of antineoplastic agent . It has the role of apoptosis inducer . It is also related to or classified as ruthenium coordination entity .
The molecule COc1ccc(CC[NH+](C)CCC[C@@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC COc1ccc(CC[NH+](C)CCC[C@@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC is an ammonium ion resulting from the protonation of the tertiary amino group of dexverapamil. It is a conjugate acid of dexverapamil . It is also related to or classified as ammonium ion derivative .
The molecule CO[C@H]1CC\C=C(\C)/C=C/C[C@H](OC)\C=C(/C)\C=C\[C@@H](C)\C=C\C(=O)O[C@@H]([C@@H](C)\C=C\C=C\1)C(\C)=C\C=C(/C)CNC(=O)[C@H](CO)NC=O CO[C@H]1CC\C=C(\C)/C=C/C[C@H](OC)\C=C(/C)\C=C\[C@@H](C)\C=C\C(=O)O[C@@H]([C@@H](C)\C=C\C=C\1)C(\C)=C\C=C(/C)CNC(=O)[C@H](CO)NC=O is A macrolide that is isolated from the marine tunicate Eudistoma cf. rigida and exhibits potent in vitro cytotoxic activity. It has the role of antineoplastic agent . It has the role of marine metabolite . Its functional parent is L-serine .  It is also related to or classified as macrolide  . It is also related to or classified as ether  . It is also related to or classified as formamides .
The molecule CO[C@H]1CC\C=C(\C)/C=C/C[C@H](OC)\C=C(/C)\C=C\[C@@H](C)\C=C(C)\C(=O)O[C@@H]([C@@H](C)\C=C\C=C\1)C(\C)=C\C=C(/C)CNC(=O)[C@H](CO)NC=O CO[C@H]1CC\C=C(\C)/C=C/C[C@H](OC)\C=C(/C)\C=C\[C@@H](C)\C=C(C)\C(=O)O[C@@H]([C@@H](C)\C=C\C=C\1)C(\C)=C\C=C(/C)CNC(=O)[C@H](CO)NC=O is A macrolide that is isolated from the marine tunicate Eudistoma cf. rigida and exhibits potent in vitro cytotoxic activity. It has the role of antineoplastic agent . It has the role of marine metabolite . Its functional parent is L-serine .  It is also related to or classified as macrolide  . It is also related to or classified as ether  . It is also related to or classified as formamides .
The molecule O=C1CCCCN1 O=C1CCCCN1 is A delta-lactam that is piperidine which is substituted by an oxo group at position 2. It has the role of EC 1.2.1.88 (L-glutamate gamma-semialdehyde dehydrogenase) inhibitor .  It is also related to or classified as delta-lactam  . It is also related to or classified as piperidones .
The molecule COc1ccc(CCN(C)CCC[C@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC COc1ccc(CCN(C)CCC[C@](C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC is A 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile that has S configuration. It is also related to or classified as 2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino}-2-(propan-2-yl)pentanenitrile  .
The molecule [Na+].[Na+].[O-][Se]([O-])(=O)=O [Na+].[Na+].[O-][Se]([O-])(=O)=O is an inorganic sodium salt having selenate as the counterion. It has the role of fertilizer . It has the role of EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor . It has the role of anticonvulsant . It is also related to or classified as inorganic sodium salt .
The molecule [H][C@@]1(C[C@H](C)[C@]2(CC[C@]3(C)C[C@@]4([H])[C@]([H])(C(=O)C[C@@]4(C)O)\C(C=O)=C/C[C@@]23[H])O1)C=C(C)C [H][C@@]1(C[C@H](C)[C@]2(CC[C@]3(C)C[C@@]4([H])[C@]([H])(C(=O)C[C@@]4(C)O)\C(C=O)=C/C[C@@]23[H])O1)C=C(C)C is A sesterterpenoid that is ophiobolane with a hydroxy group at position 3, oxo groups at positions 5 and 25, double bonds at positions 7-8 and 19-20, and an oxygen link between positions 14 and 18.  It is also related to or classified as tertiary alcohol  .   It is also related to or classified as enal  . It is also related to or classified as sesterterpenoid , oxaspiro compound , cyclic ketone .
The molecule CCCCCCCCC(OO)\C=C\CCCCCCC(O)=O CCCCCCCCC(OO)\C=C\CCCCCCC(O)=O is A hydroperoxy fatty acid that is 10-hydroperoxy derivative of (8E)-octadecenoic acid. Its functional parent is oleic acid . It is a conjugate acid of 10-hydroperoxy-8E-octadecenoate . It is also related to or classified as hydroperoxyoctadecenoic acid .
The molecule COc1ccc(C(=O)Nc2c(Cl)c[n+]([O-])cc2Cl)c2ccc(nc12)C(F)(F)F COc1ccc(C(=O)Nc2c(Cl)c[n+]([O-])cc2Cl)c2ccc(nc12)C(F)(F)F is an aromatic amide resulting from the formal condensation of the carboxy group of 8-methoxy-2-(trifluoromethyl)quinoline-5-carboxylic acid with the primary amino group of 3,5-dichloropyridin-4-amine 1-oxide. It is a potent inhibitor of phosphodiesterase IV (PDE4). It has the role of phosphodiesterase IV inhibitor .  It is also related to or classified as monocarboxylic acid amide  .  It is also related to or classified as organofluorine compound  . It is also related to or classified as quinolines , aromatic ether , pyridine N-oxides , chloropyridine , aromatic amide .
The molecule CCN(CC)C(=O)SCc1ccccc1Cl CCN(CC)C(=O)SCc1ccccc1Cl is A monothiocarbamic ester that is carbamothioic S-acid substituted by two ethyl groups at the nitrogen atom and a 2-chlorobenzyl group at the the sulfur atom. 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 monothiocarbamic ester , monochlorobenzenes .
The molecule CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC(OO)\C=C\CCCCCCC CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCC(OO)\C=C\CCCCCCC is A 1,2-diacyl-sn-glycero-3-phosphocholine in which 1 and 2-acyl groups are specified as palmitoyl (hexadecanoyl) and (10E)-9-hydroperoxyoctadecenoyl respectively. Its functional parent is hexadecanoic acid . Its functional parent is 9-hydroperoxy-10E-octadecenoic acid . It is also related to or classified as oxidized glycerophosphocholine zwitterion  . It is also related to or classified as 1,2-diacyl-sn-glycero-3-phosphocholine  .
The molecule CCCCCCC\C=C\C(CCCCCCCC([O-])=O)OO CCCCCCC\C=C\C(CCCCCCCC([O-])=O)OO is A hydroperoxy fatty acid anion resulting from the deprotonation of the carboxy group of 9-hydroperoxy-10E-octadecenoic acid. The major species at pH 7.3. It is also related to or classified as hydroperoxyoctadecenoate .
The molecule CS(O)(=O)=O.C1CCC(CC1)c1ccc2n3CCNC4CCCc(c34)c2c1 CS(O)(=O)=O.C1CCC(CC1)c1ccc2n3CCNC4CCCc(c34)c2c1 is A racemate composed of equimolar amounts of (R)- and (S)-tetrindole mesylate. It has the role of antidepressant . It has the role of serotonergic agonist . It has the role of EC 1.4.3.4 (monoamine oxidase) inhibitor . It is also related to or classified as racemate .
The molecule CCCCCCCCCCCCCCCCOC[C@@H]([NH3+])CO CCCCCCCCCCCCCCCCOC[C@@H]([NH3+])CO is an organic cation obtained by protonation of the amino group of 1-hexadecyl-2-amino-2-deoxy-sn-glycerol; major species at pH 7.3. It is also related to or classified as primary ammonium ion  . It is also related to or classified as organic cation .
The molecule Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 Nc1ccc(cc1)S(=O)(=O)Nc1ccnn1-c1ccccc1 is A sulfonamide that is sulfanilamide in which the sulfonamide nitrogen is substituted by a 1-phenyl-1H-pyrazol-5-yl group. It is a selective inhibitor of cytochrome P450 (CYP) 2C9 isozyme, and antibacterial agent. It has the role of antibacterial drug . It has the role of P450 inhibitor . It has the role of EC 1.14.13.181 (13-deoxydaunorubicin hydroxylase) inhibitor . It has the role of EC 1.14.13.67 (quinine 3-monooxygenase) inhibitor .     It is also related to or classified as sulfonamide  . It is also related to or classified as pyrazoles , substituted aniline , primary amino compound , sulfonamide antibiotic .