anonymous041/ChEBI-Augmented huggingface dataset:
The molecule CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS([O-])(=O)=O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC is A galactosylceramide sulfate(1-) in which the ceramide N-acyl group is specified as (R)-2-hydroxylignoceroyl. It is also related to or classified as beta-D-galactosylceramide sulfate(1-)  .
The molecule CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC is A D-galactosyl-N-acylsphingosine in which the ceramide N-acyl group is specified as (R)-2-hydroxylignoceroyl. Its functional parent is (R)-2-hydroxylignoceric acid . It is also related to or classified as N-acyl-beta-D-galactosylsphingosine  .
The molecule [H][C@]12COC(=O)[C@]1([H])[C@H](C1=CC(OC)=C(O)C(OC)=C1)C1=C(C=C3OCOC3=C1)[C@H]2O[C@@H]1O[C@]2([H])CO[C@]([H])(O[C@@]2([H])[C@H](O)[C@H]1O)C1=CC=CS1 [H][C@]12COC(=O)[C@]1([H])[C@H](C1=CC(OC)=C(O)C(OC)=C1)C1=C(C=C3OCOC3=C1)[C@H]2O[C@@H]1O[C@]2([H])CO[C@]([H])(O[C@@]2([H])[C@H](O)[C@H]1O)C1=CC=CS1 is A furonaphthodioxole that is a synthetic derivative of podophyllotoxin with anti-tumour activity; causes single- and double-stranded breaks in DNA and DNA-protein cross-links and prevents repair by topoisomerase II binding. It has the role of antineoplastic agent . It has the role of EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor . Its functional parent is podophyllotoxin . It is also related to or classified as beta-D-glucoside  .  It is also related to or classified as phenols  .  It is also related to or classified as gamma-lactone  . It is also related to or classified as furonaphthodioxole  . It is also related to or classified as thiophenes , aromatic ether , cyclic acetal , monosaccharide derivative .
The molecule Nc1[n+]2cnc3n(cnc13)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@@H]2[C@H](O)[C@@H]3O)[C@@H](O)[C@H]1OP([O-])([O-])=O Nc1[n+]2cnc3n(cnc13)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]3O[C@@H]2[C@H](O)[C@@H]3O)[C@@H](O)[C@H]1OP([O-])([O-])=O is A nucleotide-sugar oxoanion obtained by deprotonation of the diphosphate OH groups of 2'-phospho-cyclic ADP-ribose. Its functional parent is cyclic ADP-beta-D-ribose(2-) . It is also related to or classified as nucleotide-sugar oxoanion .
The molecule CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC is A D-galactosyl-N-acylsphingosine where the ceramide N-acyl group is docosananoyl and the D-galactosyl component has beta anomeric configuration. It has the role of mouse metabolite . Its functional parent is docosanoic acid . It is also related to or classified as N-acyl-beta-D-galactosylsphingosine  .
The molecule CS(C)=O.CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O CS(C)=O.CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O is an addition compound obtained by combining equimolar amounts of trametinib and dimethyl sulfoxide. Used for the treatment of patients with unresectable or metastatic melanoma with BRAF V600E or V600K mutations, and who have not received prior BRAF inhibitor treatment. It has the role of antineoplastic agent . It has the role of EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor . It is also related to or classified as addition compound .
The molecule CCCCCCCCCCCCCC[C@H](O)C(O)=O CCCCCCCCCCCCCC[C@H](O)C(O)=O is the S-enantiomer of 2-hydroxypalmitic acid. It is a conjugate acid of (S)-2-hydroxyhexadecanoate . It is also related to or classified as (2S)-2-hydroxy monocarboxylic acid  . It is also related to or classified as 2-hydroxyhexadecanoic acid  .
The molecule COc1ccc(C[C@H]2[NH+](C)CCc3cc(OC)c(OC)cc23)cc1O COc1ccc(C[C@H]2[NH+](C)CCc3cc(OC)c(OC)cc23)cc1O is the (R)-enantiomer of laudanine(1+). It is a conjugate acid of (R)-laudanine . It is also related to or classified as laudanine(1+)  .
The molecule O[C@H]1[C@@H](O)[C@@H](Oc2ccccc2)O[C@@H]1COP([O-])([O-])=O O[C@H]1[C@@H](O)[C@@H](Oc2ccccc2)O[C@@H]1COP([O-])([O-])=O is an organophosphate oxoanion obtained by deprotonation of the phosphate OH groups of phenyl 5-phospho-alpha-D-ribofuranoside. It is also related to or classified as organophosphate oxoanion .
The molecule CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O[C@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O[C@@H]1[C@@H](CO)O[C@H](O[C@@H]2[C@H](O)C[C@@](O)(O[C@@H]2[C@H](O)CO)C(O)=O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O CC(=O)N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](CO)O[C@@H]1O[C@H]1[C@@H](O)[C@H](O)[C@@H](CO)O[C@H]1O[C@@H]1[C@@H](CO)O[C@H](O[C@@H]2[C@H](O)C[C@@](O)(O[C@@H]2[C@H](O)CO)C(O)=O)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1O is A branched amino pentasaccharide consisting of an N-acetyl-alpha-D-galactosaminyl-(1->2)-beta-D-mannosyl-(1->4)-alpha-D-mannosyl-(1->5)-3-deoxy-alpha-D-manno-oct-2-ulosonic acid tetrasaccharide chain, to the alpha-D-mannosyl residue of which is also linked beta(1->2) a D-glucosyl residue. Epitope of Francisella tularensis. It has the role of epitope . It is also related to or classified as amino pentasaccharide .
The molecule OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 is A maleate salt obtained by combining afatinib with two molar equivalents of maleic acid. Used for the first-line treatment of patients with metastatic non-small cell lung cancer. It has the role of antineoplastic agent . It has the role of tyrosine kinase inhibitor . It is also related to or classified as maleate salt .
The molecule COC(=O)\C=C\C(=O)OC COC(=O)\C=C\C(=O)OC is an enoate ester resulting from the formal condensation of both carboxy groups of fumaric acid with methanol. Used for treatment of adults with relapsing forms of multiple sclerosis. It has the role of antipsoriatic . It has the role of immunomodulator . Its functional parent is methanol . Its functional parent is fumaric acid . It is also related to or classified as methyl ester  . It is also related to or classified as diester  . It is also related to or classified as enoate ester  .
The molecule C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O)c3C(=O)N12 C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c(O)c3C(=O)N12 is A monocarboxylic acid amide obtained by formal condensation of the carboxy group of (4R,12aS)-7-hydroxy-4-methyl-6,8-dioxo-3,4,6,8,12,12a-hexahydro-2H-pyrido[1',2':4,5]pyrazino[2,1-b][1,3]oxazine-9-carboxylic acid with the amino group of 2,4-difluorobenzylamine. Used (as its sodium salt) for treatment of HIV-1. It has the role of HIV-1 integrase inhibitor . It is a conjugate acid of dolutegravir(1-) . It is also related to or classified as secondary carboxamide  .  It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as difluorobenzene  . It is also related to or classified as organic heterotricyclic compound .
The molecule Cc1ccc(Oc2ccccc2-c2csc(N=C3NCCCN3)n2)c(C)c1 Cc1ccc(Oc2ccccc2-c2csc(N=C3NCCCN3)n2)c(C)c1 is A member of the class of  guanidines that is tetrahydropyrimidin-2(1H)-imine in which the hydrogen of the imino group is replaced by a thiazol-2-yl group which in turn is substituted by a 2-(2,4-dimethylphenoxy)phenyl group at position 4. It has been used for the topical treatment of fungal nail infections. It has the role of antifungal drug . It is also related to or classified as guanidines , aromatic ether , 1,3-thiazoles .
The molecule C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c([O-])c3C(=O)N12 C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c([O-])c3C(=O)N12 is an organic anion that is the conjugate base of dolutegravir, obtained by deptotonation of the 7-hydroxy group. It is also related to or classified as organic anion .
The molecule CNC(NCCSCc1csc(CN(C)C)n1)=C[N+]([O-])=O CNC(NCCSCc1csc(CN(C)C)n1)=C[N+]([O-])=O is A member of the class of 1,3-thiazoles having a dimethylaminomethyl substituent at position 2 and an alkylthiomethyl moiety at position 4. It has the role of H2-receptor antagonist . It has the role of cholinergic drug . It has the role of anti-ulcer drug . It is also related to or classified as organic sulfide  . It is also related to or classified as carboxamidine  . It is also related to or classified as C-nitro compound , 1,3-thiazoles , tertiary amino compound .
The molecule COC(=O)N(C)c1c(N)nc(nc1N)-c1nn(Cc2ccccc2F)c2ncccc12 COC(=O)N(C)c1c(N)nc(nc1N)-c1nn(Cc2ccccc2F)c2ncccc12 is A carbamate ester that is the methyl ester of {4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidin-5-yl}methylcarbamic acid. It is used for treatment of chronic thromboembolic pulmonary hypertension and pulmonary arterial hypertension. It has the role of antihypertensive agent . It has the role of soluble guanylate cyclase activator .  It is also related to or classified as organofluorine compound  . It is also related to or classified as carbamate ester , aminopyrimidine , pyrazolopyridine .
The molecule Br.Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1 Br.Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1 is A hydrobromide obtained by combining vortioxetine with one molar equivalent of hydrobromic acid. Used for treatment of major depressive disorder. It has the role of antidepressant . It has the role of anxiolytic drug . It has the role of serotonergic agonist . It has the role of serotonergic antagonist . It is also related to or classified as hydrobromide  .
The molecule Cc1ccc(Sc2ccccc2N2CC[NH2+]CC2)c(C)c1 Cc1ccc(Sc2ccccc2N2CC[NH2+]CC2)c(C)c1 is an organic cation that is the conjugate acid of vortioxetine, obtained by protonation of the secondary amino function. It is a conjugate acid of vortioxetine . It is also related to or classified as organic cation , ammonium ion derivative .
The molecule O=C(Nc1ncc(Cc2cccc3ccccc23)s1)C1CCCCC1 O=C(Nc1ncc(Cc2cccc3ccccc23)s1)C1CCCCC1 is A monocarboxylic acid amide obtained by the formal condensation of cyclohexanecarboxylic acid with the amino group of 5-(naphthalen-1-ylmethyl)-1,3-thiazol-2-amine. It has been shown to exhibit antifungal activity. It has the role of antifungal agent . Its functional parent is cyclohexanecarboxylic acid .  It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as naphthalenes , 1,3-thiazoles .
The molecule COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 COc1ccc(cc1OC)-c1cc(=O)c2c(OC)c(OC)c(OC)c(OC)c2o1 is A methoxyflavone that is flavone substituted by methoxy groups at positions 5, 6, 7, 8, 3' and 4' respectively. It has the role of antineoplastic agent . It has the role of plant metabolite . Its functional parent is flavone . It is also related to or classified as methoxyflavone .
The molecule COc1ccc(C[C@@H]2[NH+](C)CCc3cc(OC)c(OC)cc23)cc1O COc1ccc(C[C@@H]2[NH+](C)CCc3cc(OC)c(OC)cc23)cc1O is the (S)-enantiomer of laudanine(1+). It is a conjugate acid of (S)-laudanine . It is also related to or classified as laudanine(1+)  .
The molecule CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O CC(=O)Nc1cccc(c1)-n1c2c(C)c(=O)n(C)c(Nc3ccc(I)cc3F)c2c(=O)n(C2CC2)c1=O is A pyridopyrimidine that is used (as its dimethyl sulfoxide addition compound) for the treatment of patients with unresectable or metastatic melanoma with BRAF V600E or V600K mutations, and who have not received prior BRAF inhibitor treatment. It has the role of anticoronaviral agent . It has the role of geroprotector . It has the role of antineoplastic agent . It has the role of EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor .    It is also related to or classified as organoiodine compound  . It is also related to or classified as organofluorine compound  . It is also related to or classified as pyridopyrimidine  . It is also related to or classified as acetamides , aromatic amine , ring assembly , cyclopropanes .
The molecule [Na+].C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c([O-])c3C(=O)N12 [Na+].C[C@@H]1CCO[C@H]2Cn3cc(C(=O)NCc4ccc(F)cc4F)c(=O)c([O-])c3C(=O)N12 is an organic sodium salt that is the monosodium salt of dolutegravir. Used for treatment of HIV-1. It has the role of HIV-1 integrase inhibitor . It is also related to or classified as organic sodium salt .
The molecule CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O is an ultra-long-chain fatty acid anion that is the conjugate base of dotriacontanoic acid (lacceroic acid), obtained by deprotonation of the carboxy group. Its functional parent is 3-oxodotriacontanoyl-CoA(4-) . It is also related to or classified as ultra-long-chain fatty acid anion  . It is also related to or classified as straight-chain saturated fatty acid anion .
The molecule CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O is an ultra-long-chain fatty acid anion that is the conjugate base of tetratriacontanoic aacid, obtained by deprotonation of the carboxy group. It is also related to or classified as ultra-long-chain fatty acid anion  . It is also related to or classified as straight-chain saturated fatty acid anion .
The molecule CCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C([O-])=O CCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C([O-])=O is A hydroxy fatty acid anion that is the conjugate base of (R)-2-hydroxyoctacosanoic acid, obtained by deprotonation of the carboxy group. It is also related to or classified as very long-chain fatty acid anion  . It is also related to or classified as (2R)-2-hydroxy fatty acid anion  .
The molecule C[C@H](O)[C@@H]1O[C@H](O)[C@H](O)[C@@H]1O C[C@H](O)[C@@H]1O[C@H](O)[C@H](O)[C@@H]1O is an L-rhamnofuranose having beta-configuration at the anomeric centre. It is also related to or classified as L-rhamnofuranose  .
The molecule C=1(C=2C=CC(N(C)C)=CC2)SC=3C=C(C)C=CC3[N+]1C.[Cl-] C=1(C=2C=CC(N(C)C)=CC2)SC=3C=C(C)C=CC3[N+]1C.[Cl-] is an organic chloride salt having 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-1,3-benzothiazol-3-ium as the counterion. It is widely used to visualise and quantify the presence of amyloids, both in vitro and in vivo. It has the role of geroprotector . It has the role of fluorochrome . It has the role of histological dye . It is also related to or classified as organic chloride salt .
The molecule OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O is A hydroxy fatty acid anion that is the conjugate base of omega-hydroxydotriacontanoic acid, obtained by deprotonation of the carboxy group. It is also related to or classified as omega-hydroxy-ultra-long-chain fatty acid anion  .
The molecule CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(O)=O CCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C(O)=O is A very long-chain fatty acid that is lignoceric acid bearing an (R)-2-hydroxy substituent. Its functional parent is tetracosanoic acid . It is a conjugate acid of (R)-2-hydroxylignocerate . It is also related to or classified as 2-hydroxy fatty acid  . It is also related to or classified as very long-chain fatty acid  .
The molecule CCCCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C([O-])=O CCCCCCCCCCCCCCCCCCCCCCCCCC[C@@H](O)C([O-])=O is A hydroxy fatty acid anion that is the conjugate base of (R)-2-hydroxyoctacosanoic acid, obtained by deprotonation of the carboxy group. It is also related to or classified as (2R)-2-hydroxy fatty acid anion  . It is also related to or classified as 2-hydroxyoctacosanoate  .
The molecule [2H]C([2H])([2H])[C@]([2H])(N)C(O)=O [2H]C([2H])([2H])[C@]([2H])(N)C(O)=O is A deuterated compound that is L-alanine in which the alpha-hydrogen and the three methyl hydrogens are replaced by deuterium. It is also related to or classified as L-alpha-amino acid  . It is also related to or classified as alanine  . It is also related to or classified as deuterated compound .
The molecule OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC([O-])=O is A hydroxy fatty acid anion that is the conjugate base of omega-hydroxytriacontanoic acid, obtained by deprotonation of the carboxy group. It is also related to or classified as omega-hydroxy-ultra-long-chain fatty acid anion  . It is also related to or classified as ultra-long-chain fatty acid anion  .
The molecule CN(C)c1ccc(cc1)-c1sc2cc(C)ccc2[n+]1C CN(C)c1ccc(cc1)-c1sc2cc(C)ccc2[n+]1C is A benzothiazolium ion obtained by methylation of the thiazole nitrogen of 2-[4-(dimethylamino)phenyl]-6-methyl-1,3-benzothiazole; the cationic component of thioflavin T. It is also related to or classified as benzothiazolium ion .
The molecule C[C@@H](C([O-])=O)[n+]1cc(O)ccc1CO C[C@@H](C([O-])=O)[n+]1cc(O)ccc1CO is an iminium betaine that is L-alanine in which the amino group is replaced by a 5-hydroxy-2-(hydroxymethyl)pyridinium-1-yl moiety. It has the role of flavouring agent . Its functional parent is L-alanine . It is also related to or classified as iminium betaine .
The molecule CCC1=C(CO)C2=Cc3c(C=C)c(C)c4C=C5[C@@H](C)[C@H](CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C6=[N+]5[Mg--]5(n34)n3c(=CC1=[N+]25)c(C)c1C(=O)[C@H](C(=O)OC)C6=c31 CCC1=C(CO)C2=Cc3c(C=C)c(C)c4C=C5[C@@H](C)[C@H](CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C6=[N+]5[Mg--]5(n34)n3c(=CC1=[N+]25)c(C)c1C(=O)[C@H](C(=O)OC)C6=c31 is A member of the class of chlorophyll that is chlorophyll a substituted at position 7(1) by a hydroxy group. Its functional parent is chlorophyll a . It is a conjugate acid of 7(1)-hydroxychlorophyll a(1-) . It is also related to or classified as methyl ester  . It is also related to or classified as chlorophyll  .
The molecule [2H]C([2H])(C(O)=O)C([2H])([2H])C([2H])(N)C(O)=O [2H]C([2H])(C(O)=O)C([2H])([2H])C([2H])(N)C(O)=O is A deuterated compound that is glutamic acid in which the hydrogens at positions 2, 3, 3, 4 and 4 are replaced by deuterium. It is also related to or classified as deuterated compound , non-proteinogenic alpha-amino acid .
The molecule [2H]C([2H])(C(O)=O)C(O)(C(O)=O)C([2H])([2H])C(O)=O [2H]C([2H])(C(O)=O)C(O)(C(O)=O)C([2H])([2H])C(O)=O is A deuterated compound that is citric acid in which the four methylene hydrogens are replaced by deuterium. It is also related to or classified as tertiary alcohol  . It is also related to or classified as tricarboxylic acid , deuterated compound .
The molecule C[C@@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)c(O)c2)c(O)c3=O)[C@H](O)[C@H](O)[C@H]1O C[C@@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)c(O)c2)c(O)c3=O)[C@H](O)[C@H](O)[C@H]1O is A quercetin O-glycoside that is quercetin attached to a alpha-L-rhamnopyranosyl moiety at position 7 via a glycosidic linkage. It has the role of metabolite . Its functional parent is alpha-L-rhamnopyranose . It is also related to or classified as alpha-L-rhamnoside  . It is also related to or classified as flavonols  . It is also related to or classified as tetrahydroxyflavone  . It is also related to or classified as monosaccharide derivative , quercetin O-glycoside .
The molecule C[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O C[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@H]1O is A quercetin O-glycoside that is  quercetin  attached to a beta-D-fucopyranosyl moiety at position 3 via a glycosidic linkage. It has the role of metabolite . Its functional parent is beta-D-fucose . It is also related to or classified as beta-D-fucoside  . It is also related to or classified as tetrahydroxyflavone  . It is also related to or classified as monosaccharide derivative , quercetin O-glycoside .
The molecule CCCCCCCCCCCCCCCCOC[C@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)OC(C)=O CCCCCCCCCCCCCCCCOC[C@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)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 oleoyl. Its functional parent is oleic 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 C[C@@H](O)[C@H]1O[C@@H](O)[C@@H](O)[C@H]1O C[C@@H](O)[C@H]1O[C@@H](O)[C@@H](O)[C@H]1O is A D-rhamnofuranose having beta-configuration at the anomeric centre. It has the role of metabolite . It is also related to or classified as D-rhamnofuranose  .
The molecule C[C@H](O)[C@@H]1O[C@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H]1O C[C@H](O)[C@@H]1O[C@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H]1O is A quercetin O-glycoside that is quercetin attached to a beta-L-rhamnofuranosyl moiety at position 3 via a glycosidic linkage. It has the role of metabolite . It is also related to or classified as tetrahydroxyflavone  .  It is also related to or classified as beta-L-rhamnofuranoside  . It is also related to or classified as monosaccharide derivative , quercetin O-glycoside .
The molecule CCCCCCCCCCCCCCCCOCC(O)COC(=O)CCCCCCC\C=C/CCCCCCCC CCCCCCCCCCCCCCCCOCC(O)COC(=O)CCCCCCC\C=C/CCCCCCCC is A 1-alkyl-3-acylglycerol in which the alkyl and acyl groups are specified as palmityl (hexadecyl) and oleoyl. Its functional parent is oleic acid . Its functional parent is 1-O-palmitylglycerol . It is also related to or classified as 1-alkyl-3-acylglycerol  .
The molecule [2H]c1c([2H])c([2H])c(CC(N)C(O)=O)c([2H])c1[2H] [2H]c1c([2H])c([2H])c(CC(N)C(O)=O)c([2H])c1[2H] is A deuterated compound that is phenylalanine in which the five aromatic hydrogens are replaced by deuterium. It is also related to or classified as deuterated compound , non-proteinogenic alpha-amino acid .
The molecule CCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS(O)(=O)=O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC CCCCCCCCCCCCCCCC[C@@H](O)C(=O)N[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OS(O)(=O)=O)[C@H]1O)[C@H](O)\C=C\CCCCCCCCCCCCC is A galactosylceramide sulfate in which the sulfo group is located at position 3 and the ceramide N-acyl group is specified as (R)-2-hydroxystearoyl. It is a conjugate acid of 1-(3-O-sulfo-beta-D-galactosyl)-N-[(2R)-2-hydroxystearoyl]sphingosine(1-) . It is also related to or classified as galactosylceramide sulfate  . It is also related to or classified as N-acyl-beta-D-galactosylsphingosine  .
The molecule CCCCCCCC\C=C/CCCCCCCC(=O)NCCOC(=O)CCCCCCC\C=C/CCCCCCCC CCCCCCCC\C=C/CCCCCCCC(=O)NCCOC(=O)CCCCCCC\C=C/CCCCCCCC is A fatty acid ester obtained by formal condensation of the carboxy group of oleic acid with the hydroxy group of oleoyl ethanolamide. Its functional parent is ethanolamine . Its functional parent is oleic acid . It is also related to or classified as fatty acid ester  . It is also related to or classified as N,O-diacylethanolamine  . It is also related to or classified as fatty amide .
The molecule CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)NC(C)=O CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](COC(=O)CCCCCCC\C=C/CCCCCCCC)NC(C)=O is A 1-O-acyl-N-acylsphingosine in which the N- and O-acyl groups are specified as acetyl and oleoyl respectively. Its functional parent is oleic acid . Its functional parent is N-acetylsphingosine . It is also related to or classified as 1-O-acyl-N-acetylsphingosine  .