anonymous041/ChEBI-Augmented huggingface dataset:
The molecule CC[C@@H]1[C@@](/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H](C(=O)[C@H](C(=O)O1)C)C)O[C@H]2[C@@H]([C@H](C[C@H](O2)C)N(C)C)O)C)C)(C)O is a macrolide antibiotic that is biosynthesised by Streptomyces venezuelae. It has a role as a bacterial metabolite. It is a macrolide antibiotic, a monosaccharide derivative and an enone. It derives from a narbonolide. It is a conjugate base of a pikromycin(1+).
The molecule CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/COP(=O)([O-])OP(=O)([O-])[O-])/C)/C)/C)/C)/C)C is the trianion resulting from the removal of the three protons from the diphosphate group of all-trans-hexaprenyl diphosphate; major species at pH 7.3. It is a conjugate base of an all-trans-hexaprenyl diphosphate.
The molecule CC/C=C\\C[C@@H](/C=C/[C@H]1[C@H]2C[C@@H]([C@@H]1C/C=C\\CCCC(=O)O)OO2)OO is a member of the class of prostaglandins G that is 9,11-epidioxyprosta-5,13,17-trienoic acid carrying an additional hydroperoxy substituent at the 15S-position. It is a prostaglandins G, a peroxol and an olefinic compound. It is a conjugate acid of a prostaglandin G3(1-).
The molecule CCCCC\C=C/C\C=C/CC1OC1C\C=C/CCCC([O-])=O CCCCC\C=C/C\C=C/CC1OC1C\C=C/CCCC([O-])=O is an icosanoid anion that is the conjugate base of 8,9-EET, obtained by deprotonation of the carboxy group; major species at pH 7.3.   It is also related to or classified as long-chain fatty acid anion  . It is also related to or classified as EET(1-) , polyunsaturated fatty acid anion , icosanoid anion .
The molecule O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=C(OC3=C(C2=O)C(O)=C(O)C(O)=C3)C4=CC(O)=C(O)C=C4)CO O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=C(OC3=C(C2=O)C(O)=C(O)C(O)=C3)C4=CC(O)=C(O)C=C4)CO is Tagetiin. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule C[C@@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C)[C@H](C)CO)C)CN(C)CC4CC4 C[C@@H]1CCCCO[C@H]([C@@H](CN(C(=O)C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)C)[C@H](C)CO)C)CN(C)CC4CC4 is N-[(3R,9R,10R)-9-[[cyclopropylmethyl(methyl)amino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-4-methylbenzenesulfonamide. It is also related to or classified as lactam  . It is also related to or classified as azamacrocycle .
The molecule [H][C@@](C)(CCC[C@@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C [H][C@@](C)(CCC[C@@H](C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)[C@@]1([H])CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C is tetraanion of (25R)-3alpha,7alpha-dihydroxy-5beta-cholestan-26-oyl-CoA arising from deprotonation of phosphate and diphosphate functions. It is also related to or classified as steroidal acyl-CoA(4-)  .
The molecule [C@H]1(S/C(=N\O)/CC=2C3=CC=CC=C3NC2)[C@H](O)[C@H]([C@@H]([C@H](O1)CO)O)O [C@H]1(S/C(=N\O)/CC=2C3=CC=CC=C3NC2)[C@H](O)[C@H]([C@@H]([C@H](O1)CO)O)O is an indolylmethyl desulfoglucosinolate in which the C=N double bond has Z configuration. It is also related to or classified as indolylmethyl desulfoglucosinolate  .
The molecule C[C@H](CCC1=CC=CC=C1)NC[C@@H](O)C1=CC(C(N)=O)=C(O)C=C1 C[C@H](CCC1=CC=CC=C1)NC[C@@H](O)C1=CC(C(N)=O)=C(O)C=C1 is A 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide that has 1S,2R-configuration. It is also related to or classified as 2-hydroxy-5-{1-hydroxy-2-[(4-phenylbutan-2-yl)amino]ethyl}benzamide  .
The molecule C[C@@H]1O[C@@H](OCCCCCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2OP([O-])([O-])=O)N3C=NC4=C(N)N=CN=C34)[C@H](O)C[C@H]1O C[C@@H]1O[C@@H](OCCCCCC[C@@H](O)CC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2OP([O-])([O-])=O)N3C=NC4=C(N)N=CN=C34)[C@H](O)C[C@H]1O is conjugate base of bhos#10-CoA. It is also related to or classified as organic molecular entity .
The molecule CC1=C[C@H]2[C@H](C[C@@H]3[C@H]1CC[C@]3(C)O)C(=C)C(=O)O2 is a sesquiterpene lactone that is 3a,4,4a,5,6,7,7a,9a-octahydroazuleno[6,5-b]furan-2(3H)-one substituted by a hydroxy group at position 5, methyl groups at positions 5 and 8 and a methylidene group at position 3 (the 3aR,4aR,5S,7aR,9aS stereoisomer). It has been isolated from the aerial parts of Inula hupehensis. It has a role as a metabolite, an anti-inflammatory agent and a plant metabolite. It is a gamma-lactone, an organic heterotricyclic compound, a sesquiterpene lactone and a tertiary alcohol.
The molecule C1=CC(=CC=C1C(=O)[O-])Cl is a chlorobenzoate that is the conjugate base of 4-chlorobenzoic acid. It has a role as a bacterial xenobiotic metabolite. It derives from a benzoate. It is a conjugate base of a 4-chlorobenzoic acid.
The molecule CCCCCCCCCCCCO is a fatty alcohol that is dodecane in which a hydrogen from one of the methyl groups is replaced by a hydroxy group. It is registered for use in apple and pear orchards as a Lepidopteran pheromone/sex attractant, used to disrupt the mating behaviour of certain moths whose larvae destroy crops. It has a role as a cosmetic, a pheromone, an insect attractant, a pesticide and a plant metabolite. It is a primary alcohol, a fatty alcohol and a member of dodecanols. It derives from a hydride of a dodecane.
The molecule O=C1N[C@H](C(=O)N[C@H]1CC2=CC=CC=C2)C[C@@]3(O)C4=C(C=CC=C4)N5[C@@H]3N6[C@@H](CCCC6)C5=O O=C1N[C@H](C(=O)N[C@H]1CC2=CC=CC=C2)C[C@@]3(O)C4=C(C=CC=C4)N5[C@@H]3N6[C@@H](CCCC6)C5=O is Lumpidin. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule C=1(C(=C2C(OC(C=3C=CC(O)=CC3)=CC2=O)=C(C1O)C4[C@@H]([C@H]([C@@H](C(O4)CO)O)O)O)O)C5OC[C@H]([C@@H]([C@H]5O)O)O C=1(C(=C2C(OC(C=3C=CC(O)=CC3)=CC2=O)=C(C1O)C4[C@@H]([C@H]([C@@H](C(O4)CO)O)O)O)O)C5OC[C@H]([C@@H]([C@H]5O)O)O is 8-C-glucopyranosyl-6-C-xylopyranosylapigenin. Its functional parent is apigenin . It is also related to or classified as polyphenol , trihydroxyflavone , flavone C-glycoside .
The molecule O=C1/C(/C(=CC([C@]1(O)C)=O)C)=C(\O)/C2=C(O)C=C(OC)C=C2 O=C1/C(/C(=CC([C@]1(O)C)=O)C)=C(\O)/C2=C(O)C=C(OC)C=C2 is Penicillenone. It is also related to or classified as phenols  . It is also related to or classified as methoxybenzenes .
The molecule O=C1C2=C(O)C=C(OC)C=C2C(=O)[C@]34[C@]1(O3)[C@H](O[C@@H](C4)CC(=O)N)CCC O=C1C2=C(O)C=C(OC)C=C2C(=O)[C@]34[C@]1(O3)[C@H](O[C@@H](C4)CC(=O)N)CCC is Hypogeamicin B. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule C=1(C(=C(C2=C(C1[C@H]3[C@@H]([C@@H]([C@H](CO3)O)O)O)OC(=CC2=O)C4=CC=C(C=C4)O)O)[C@H]5[C@@H]([C@@H]([C@H](CO5)O)O)O)O C=1(C(=C(C2=C(C1[C@H]3[C@@H]([C@@H]([C@H](CO3)O)O)O)OC(=CC2=O)C4=CC=C(C=C4)O)O)[C@H]5[C@@H]([C@@H]([C@H](CO5)O)O)O)O is 6,8-di-C-alpha-L-arabinosylapigenin. Its functional parent is apigenin . It is also related to or classified as polyphenol , trihydroxyflavone , flavone C-glycoside .
The molecule CO[C@@H]1[C@@H](O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC)O[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O)[C@@H]1O CO[C@@H]1[C@@H](O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC)O[C@@H]1[C@@H](O)[C@H](C)O[C@@H](O)[C@@H]1O is A glycosylrhamnose derivative consisting of alpha-L-rhamnopyranose having a 4-O-acetyl-2,3-di-O-methyl-alpha-L-galactopyranosyl residue attached at the 3-position. It is also related to or classified as glycosylrhamnose derivative .
The molecule S1SS[C@]23N([C@@H]4C[C@]5(O[C@H](C)C(C5=O)(C)C)[C@H]([C@@]4(C2)O)OC(=O)C)C([C@@](S1)(N(C)C3=O)CO)=O S1SS[C@]23N([C@@H]4C[C@]5(O[C@H](C)C(C5=O)(C)C)[C@H]([C@@]4(C2)O)OC(=O)C)C([C@@](S1)(N(C)C3=O)CO)=O is Sirodesmin K. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule CO[C@@H]1[C@H](O)O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC CO[C@@H]1[C@H](O)O[C@@H](C)[C@@H](OC(C)=O)[C@H]1OC is A monosaccharide derivative  that is the 4-O-acetyl-2,3-di-O-methyl derivative of alpha-L-fucopyranose. It has the role of epitope . Its functional parent is alpha-L-fucose . It is also related to or classified as monosaccharide derivative .
The molecule [H][C@]12SCC(Cl)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C(O)=O [H][C@]12SCC(Cl)=C(N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1)C(O)=O is A cephalosporin bearing chloro and (R)-2-amino-2-phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton. It has the role of antibacterial drug . It has the role of drug allergen . It is also related to or classified as cephalosporin  .
The molecule C1=CC=C2C(=C1)C3=CC=CC=C3S2=O C1=CC=C2C(=C1)C3=CC=CC=C3S2=O is A member of the class of dibenzothiophenes that is the 5-oxo derivative of dibenzothiophene. It has the role of metabolite . Its functional parent is dibenzothiophene . It is also related to or classified as dibenzothiophenes .
The molecule S([C@@]1(N(C(=O)C(=O)NC1=O)C)C)C S([C@@]1(N(C(=O)C(=O)NC1=O)C)C)C is Lasiodipline C. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule CC1=CC(=O)CC(C)(C)C1 CC1=CC(=O)CC(C)(C)C1 is A cyclic ketone, the structure of which is that of cyclohex-2-en-1-one substituted by methyl groups at positions 3, 5 and 5. It has the role of solvent . It has the role of plant metabolite .  It is also related to or classified as enone  . It is also related to or classified as cyclic ketone .
The molecule O=C1N[C@]2(C(=O)O[C@]2([C@H]1C(O)CCCCC)C)[C@@H](O)[C@@H]3C=CCCC3 O=C1N[C@]2(C(=O)O[C@]2([C@H]1C(O)CCCCC)C)[C@@H](O)[C@@H]3C=CCCC3 is Cinnabaramide B. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule C[C@@H]1O[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](C)O[C@H]2O[C@H]2[C@@H](O)[C@@H](O[C@@H](C)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](O)[C@@H]2NC(C)=O)[C@H](O)[C@H](O)[C@H]1O C[C@@H]1O[C@@H](O[C@@H]2[C@H](O)[C@@H](O)[C@H](C)O[C@H]2O[C@H]2[C@@H](O)[C@@H](O[C@@H](C)[C@@H]2O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](O)[C@@H]2NC(C)=O)[C@H](O)[C@H](O)[C@H]1O is an amino pentasaccharide that is the core polysaccharide sequence for the O-antigen of the Gram-negative bacterium Shigella flexneri. It is also related to or classified as amino pentasaccharide .
The molecule C(\C([C@H]1[C@H](C/C=C\CCCCC)O1)O)=C\C/C=C\CCCC(=O)O C(\C([C@H]1[C@H](C/C=C\CCCCC)O1)O)=C\C/C=C\CCCC(=O)O is A hepoxilin having (5Z,9E,14Z) double bond stereochemistry, a 10-hydroxy substituent and an (11S,12S)-epoxy group. It has the role of human xenobiotic metabolite . It has the role of algal metabolite . Its functional parent is all-cis-icosa-5,8,14-trienoic acid . It is a conjugate acid of hepoxilin B3(1-) .    It is also related to or classified as long-chain fatty acid  . It is also related to or classified as hydroxy polyunsaturated fatty acid , hepoxilin , epoxy fatty acid , trienoic fatty acid .
The molecule O=C1N(C[C@@H](O)N(C1=C)C(=O)/C=C/C=C\CC(C)C)C O=C1N(C[C@@H](O)N(C1=C)C(=O)/C=C/C=C\CC(C)C)C is Corallorazine A. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule O=C1N[C@@H](C(=O)N[C@@H]1CC2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3 O=C1N[C@@H](C(=O)N[C@@H]1CC2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3 is 3-[(2R,5R)-5-benzyl-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule ClC1C=CC=CC1Cl ClC1C=CC=CC1Cl is 5,6-Dichloro-1,3-cyclohexadiene. It is also related to or classified as organochlorine compound  . It is also related to or classified as cyclohexadiene  .
The molecule NC(CCCC(N)C([O-])=O)C([O-])=O NC(CCCC(N)C([O-])=O)C([O-])=O is A dicarboxylic acid dianion that is the conjugate base of 2,6-diaminopimelic acid. It has the role of Escherichia coli metabolite . Its functional parent is pimelate(2-) . It is also related to or classified as dicarboxylic acid dianion  .
The molecule CCCCC\C=C/CCCC\C=C/C\C=C/CCCC(O)=O CCCCC\C=C/CCCC\C=C/C\C=C/CCCC(O)=O is an icosatrienoic acid with three cis-double bonds at positions 5, 8 and 14. It is also related to or classified as fatty acid 20:3  .
The molecule C=1(C(=C(C2=C(C1[C@@H]3[C@@H]([C@H]([C@H](CO3)O)O)O)OC(=CC2=O)C4=CC=C(C=C4)O)O)[C@@H]5[C@@H]([C@@H]([C@@H](CO5)O)O)O)O C=1(C(=C(C2=C(C1[C@@H]3[C@@H]([C@H]([C@H](CO3)O)O)O)OC(=CC2=O)C4=CC=C(C=C4)O)O)[C@@H]5[C@@H]([C@@H]([C@@H](CO5)O)O)O)O is 6-C-D-Xylopyranosyl-8-C-L-arabinopyranosylapigenin. Its functional parent is apigenin . It is also related to or classified as C-glycosyl compound , trihydroxyflavone .
The molecule S(OC)C(=O)C1=NC(C(SOC)=O)=CC=C1 S(OC)C(=O)C1=NC(C(SOC)=O)=CC=C1 is 2,6-di[(methoxythio)carbonyl]pyridine. It is also related to or classified as pyridinemonocarboxylic acid , aromatic carboxylic acid .
The molecule C=1(C(=C2C(OC(C=3C=CC(O)=CC3)=CC2=O)=C(C1O)[C@@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)O)[C@H]5OC[C@@H]([C@@H]([C@H]5O)O)O C=1(C(=C2C(OC(C=3C=CC(O)=CC3)=CC2=O)=C(C1O)[C@@H]4[C@@H]([C@H]([C@@H](CO4)O)O)O)O)[C@H]5OC[C@@H]([C@@H]([C@H]5O)O)O is 6-C-L-arabinopyranosyl-8-C-D-xylopyranosylapigenin. Its functional parent is apigenin . It is also related to or classified as C-glycosyl compound , trihydroxyflavone .
The molecule O=C1N[C@H](C(=O)N[C@@H]1CC2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3 O=C1N[C@H](C(=O)N[C@@H]1CC2=CC=CC=C2)CCC(=O)NCCC3=CC=CC=C3 is 3-[(2S,5R)-5-benzyl-3,6-dioxopiperazin-2-yl]-N-(2-phenylethyl)propanamide. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule Cl.COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O Cl.COc1ccc(cc1)[C@@H]1Sc2ccccc2N(CCN(C)C)C(=O)[C@@H]1OC(C)=O is A hydrochloride salt resulting from the reaction of equimolar amounts of diltiazem and hydrogen chloride. A calcium-channel blocker and vasodilator, it is used in the management of angina pectoris and hypertension. It has the role of vasodilator agent . It has the role of antihypertensive agent . It has the role of calcium channel blocker . It is also related to or classified as hydrochloride .
The molecule O=C1C=2C(OC(=C1)C)=C(C3=C(O)C=C(OC)C=4C3=CC=5OC(C)=CC(C5C4O)=O)C6=CC(OC)=CC(=C6C2O)OC O=C1C=2C(OC(=C1)C)=C(C3=C(O)C=C(OC)C=4C3=CC=5OC(C)=CC(C5C4O)=O)C6=CC(OC)=CC(=C6C2O)OC is Rubasperone A. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule C=1([C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2OC3O[C@H]([C@@H]([C@H]([C@H]3O)O)O)C)O)CO)C(=C4C(OC(C=5C=CC(O)=CC5)=CC4=O)=CC1O)O C=1([C@@H]2O[C@@H]([C@@H](O)[C@@H]([C@H]2OC3O[C@H]([C@@H]([C@H]([C@H]3O)O)O)C)O)CO)C(=C4C(OC(C=5C=CC(O)=CC5)=CC4=O)=CC1O)O is isovitexin 2''-O-rhamnoside. Its functional parent is isovitexin . It is also related to or classified as trihydroxyflavone , flavone C-glycoside .
The molecule CC(C)=CCc1cc(cc(CC=C(C)C)c1O)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 CC(C)=CCc1cc(cc(CC=C(C)C)c1O)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 is A trihydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7 and 4' and prenyl groups at positions 3' and 5' respectively. It has the role of metabolite . It is also related to or classified as 4'-hydroxyflavanones  . It is also related to or classified as phenols  . It is also related to or classified as trihydroxyflavanone .
The molecule [H][C@@]1(O[C@](O)(C[C@@H](O[C@]2(O[C@]([H])([C@H](O)CO)[C@H](O)[C@H](O)[C@@H]2O)C(O)=O)[C@H]1O)C(O)=O)[C@H](O)CO [H][C@@]1(O[C@](O)(C[C@@H](O[C@]2(O[C@]([H])([C@H](O)CO)[C@H](O)[C@H](O)[C@@H]2O)C(O)=O)[C@H]1O)C(O)=O)[C@H](O)CO is A disaccharide comprising a D-glycero-alpha-D-talo-oct-2-ulosonyl unit in (2->4) linkage with 3-deoxy-alpha-D-manno-oct-2-ulopyranonosonic acid; it forms part of the core structure of bacterial lipopolysaccharides. It is also related to or classified as disaccharide  .
The molecule O1[C@H](C(O)(C)C)[C@H](O)[C@@H](O)[C@@]2([C@@H]1CC[C@]3([C@H]2CC[C@@H]4[C@@]3(C=5NC=6C=CC=CC6C5C4)C)C)O O1[C@H](C(O)(C)C)[C@H](O)[C@@H](O)[C@@]2([C@@H]1CC[C@]3([C@H]2CC[C@@H]4[C@@]3(C=5NC=6C=CC=CC6C5C4)C)C)O is (2S,3R,4R,4aS,4bR,6aS,12bS,12cS,14aS)-4a-demethylpaspaline-3,4,4a-triol. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule CCOP(=S)(OCC)Oc1cc(on1)-c1ccccc1 CCOP(=S)(OCC)Oc1cc(on1)-c1ccccc1 is an organic thiophosphate  that is O,O-diethyl hydrogen phosphorothioate in which the hydrogen of the hydroxy group is replaced by a 5-phenyl-1,2-oxazol-3-yl group. It has the role of agrochemical . It has the role of EC 3.1.1.7 (acetylcholinesterase) inhibitor . Its functional parent is 5-phenylisoxazol-3-ol . It is also related to or classified as organothiophosphate insecticide , organic thiophosphate .
The molecule O1[C@H]([C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)C2=C(O)C([C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)=C4OC(=CC(=O)C4=C2O)C5=CC=C(O)C=C5 O1[C@H]([C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)C2=C(O)C([C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)=C4OC(=CC(=O)C4=C2O)C5=CC=C(O)C=C5 is A C-glycosyl compound that is apigenin substituted by a beta-D-glucosyl group and a beta-D-xylosyl group at positions 6 and 8 respectively. It has the role of plant metabolite . Its functional parent is isovitexin . It is also related to or classified as C-glycosyl compound , trihydroxyflavone .
The molecule O=C1C2=C(O)C=C(OC)C(=C2[C@H](OC)[C@@H]3[C@H]1CO[C@](C3)(O)C)O O=C1C2=C(O)C=C(OC)C(=C2[C@H](OC)[C@@H]3[C@H]1CO[C@](C3)(O)C)O is 5-methoxydihydrofusarubin B. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule CC1(C)Oc2ccc(cc2C=C1)[C@@H]1CC(=O)c2ccc(O)cc2O1 CC1(C)Oc2ccc(cc2C=C1)[C@@H]1CC(=O)c2ccc(O)cc2O1 is A monohydroxyflavanone that is (2S)-2',2'-dimethyl-2,3-dihydro-2'H,4H-2,6'-bichromen-4-one carrying a hydroxy substituent at position 7. It has the role of apoptosis inhibitor . It has the role of plant metabolite . It is also related to or classified as phenols  . It is also related to or classified as monohydroxyflavanone .
The molecule C=12C(=C(C=C(C1C(C=C(O2)C3=CC=C(C(=C3)O)O)=O)O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)OC5O[C@H]([C@@H]([C@H]([C@H]5O)O)O)C C=12C(=C(C=C(C1C(C=C(O2)C3=CC=C(C(=C3)O)O)=O)O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)OC5O[C@H]([C@@H]([C@H]([C@H]5O)O)O)C is orientin 2''-O-rhamnoside. Its functional parent is orientin . It is also related to or classified as tetrahydroxyflavone  . It is also related to or classified as flavone C-glycoside .
The molecule O=C1OC[C@@H]2C=C[C@@H]3[C@@]([C@H]2C1)(CCC[C@@]3(C(=O)O)C)C O=C1OC[C@@H]2C=C[C@@H]3[C@@]([C@H]2C1)(CCC[C@@]3(C(=O)O)C)C is Acrostalidic acid. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule O=C(OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COC(=O)C(N=C)=C(C)C)C(N=C)=C(C)C O=C(OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COC(=O)C(N=C)=C(C)C)C(N=C)=C(C)C is A32390A. Its functional parent is alpha-amino acid . It is also related to or classified as organonitrogen compound , organooxygen compound .
The molecule O=C(O)/C=C/C=C/[C@@H]1[C@@H]2[C@@H](C=C[C@@H]1C)C[C@@H](COC(=O)C)C[C@H]2C O=C(O)/C=C/C=C/[C@@H]1[C@@H]2[C@@H](C=C[C@@H]1C)C[C@@H](COC(=O)C)C[C@H]2C is Tanzawaic acid N. It is also related to or classified as medium-chain fatty acid  .
The molecule [Cl-].C[NH3+] [Cl-].C[NH3+] is the hydrochloride formed from methylamine. It is also related to or classified as hydrochloride , organoammonium salt , one-carbon compound .
The molecule [H][C@]1(CC=C(C)C(=O)O1)[C@@H](C)[C@@]1([H])CC[C@@]2(C)[C@]3([H])CC[C@@]4([H])[C@@](C)([C@H](CC[C@@]44C[C@@]34CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(O)=O [H][C@]1(CC=C(C)C(=O)O1)[C@@H](C)[C@@]1([H])CC[C@@]2(C)[C@]3([H])CC[C@@]4([H])[C@@](C)([C@H](CC[C@@]44C[C@@]34CC[C@]12C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(O)=O is A triterpenoid saponin that is (22S,24Z)-3beta-hydroxy-26-oxo-22,26-epoxy-9beta,19-cyclolanost-24-en-28-oic acid having a beta-D-glucosyl residue attached at position 3 via a glycosidic bond. It has the role of plant metabolite . It is also related to or classified as pentacyclic triterpenoid , steroid lactone , triterpenoid saponin .
The molecule ClC1=C(O)C2=C(O)C=3C(=O)C=C(C)OC3C=C2C(C1=O)=O ClC1=C(O)C2=C(O)C=3C(=O)C=C(C)OC3C=C2C(C1=O)=O is 7-Chlororubrocashmeriquinone. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule O=CCCCCCC O=CCCCCCC is an n-alkanal resulting from the oxidation of the alcoholic hydroxy group of heptan-1-ol to the corresponding aldehyde. An endogenous aldehyde coming from membrane lipid oxidation, it is found in the blood of lung cancer patients and has been regarded as a potential biomarker of lung cancer. It has the role of biomarker . It is also related to or classified as n-alkanal  . It is also related to or classified as saturated fatty aldehyde  . It is also related to or classified as medium-chain fatty aldehyde  .
The molecule O=C1C(C2=C(O)C=C(O)C=3C2=CC=4O[C@H](C)[C@H](C(C4C3O)=O)C)=C5C(=C(O)C6=C(O)C=C(OC6=C5)C)C(=C1)O O=C1C(C2=C(O)C=C(O)C=3C2=CC=4O[C@H](C)[C@H](C(C4C3O)=O)C)=C5C(=C(O)C6=C(O)C=C(OC6=C5)C)C(=C1)O is Ustilaginoidin N. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule S1C=2C(=O)NCC=CC=C[C@@H](O)C[C@@H](CC3=NC(C(N[C@H](C1)C(=O)O[C@@H](CC2)C)=O)=CO3)O S1C=2C(=O)NCC=CC=C[C@@H](O)C[C@@H](CC3=NC(C(N[C@H](C1)C(=O)O[C@@H](CC2)C)=O)=CO3)O is Griseoviridin. It is also related to or classified as lactam  . It is also related to or classified as macrolide  .
The molecule CNC(C)C(=O)c1ccc(C)cc1 CNC(C)C(=O)c1ccc(C)cc1 is an aromatic ketone that is propiophenone substituted at C-4 and at C-beta with methyl and methylamino groups respectively. It is a synthetic stimulant and entactogen drug of the amphetamine and cathinone classes. It has the role of xenobiotic . It has the role of environmental contaminant . Its functional parent is propiophenone . It is also related to or classified as amphetamines , secondary amino compound , aromatic ketone .
The molecule ClC1C=CC2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl ClC1C=CC2C1C1(Cl)C(Cl)=C(Cl)C2(Cl)C1(Cl)Cl is A cyclodiene organochlorine insecticide that is 3a,4,7,7a-tetrahydro-1H-4,7-methanoindene substituted by chlorine atoms at positions 1, 4, 5, 6, 7, 8 and 8. Formerly used to kill termites, ants and other insects in agricultural and domestic situations. It has the role of antibacterial agent . It has the role of agrochemical . It has the role of antifungal agent . It has the role of GABA-gated chloride channel antagonist . It has the role of persistent organic pollutant . It is also related to or classified as cyclodiene organochlorine insecticide .
The molecule [H][C@]1(Nc2c(N[C@H]1C)nc(N)[nH]c2=O)[C@@H](C)Nc1ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP(O)(=O)O[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[C@@H](O)[C@H]2O)cc1 [H][C@]1(Nc2c(N[C@H]1C)nc(N)[nH]c2=O)[C@@H](C)Nc1ccc(C[C@H](O)[C@H](O)[C@H](O)CO[C@H]2O[C@H](COP(O)(=O)O[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O)[C@@H](O)[C@H]2O)cc1 is the L-glutamide of 5,6,7,8-tetrahydromethanopterin. It is a conjugate acid of 5,6,7,8-tetrahydrosarcinapterin(4-) . It is also related to or classified as tetrahydromethanopterin .
The molecule O=C1OC(O)[C@@]23O[C@@H]2[C@H]4OC([C@@]5([C@H]4[C@@](C3=C1)(CCC5)C)C)=O O=C1OC(O)[C@@]23O[C@@H]2[C@H]4OC([C@@]5([C@H]4[C@@](C3=C1)(CCC5)C)C)=O is CJ-14515. It is also related to or classified as organic heterotricyclic compound , organooxygen compound .
The molecule [H][C@]12SCC(CSc3nnnn3C)=C(N1C(=O)[C@H]2NC(=O)[C@H](O)c1ccccc1)C(O)=O [H][C@]12SCC(CSc3nnnn3C)=C(N1C(=O)[C@H]2NC(=O)[C@H](O)c1ccccc1)C(O)=O is A cephalosporin compound having (R)-mandelamido and N-methylthiotetrazole side-groups. It has the role of antibacterial drug . It is a conjugate acid of cefamandole(1-) . It is also related to or classified as cephalosporin  . It is also related to or classified as semisynthetic derivative .