anonymous041/ChEBI-Augmented huggingface dataset:
The molecule C[C@H](O)C(O)=O C[C@H](O)C(O)=O is an optically active form of lactic acid having (S)-configuration. It has the role of Escherichia coli metabolite . It has the role of human metabolite . It is a conjugate acid of (S)-lactate . It is also related to or classified as (2S)-2-hydroxy monocarboxylic acid  . It is also related to or classified as 2-hydroxypropanoic acid  .
The molecule C[C@H](O)[C@H](O)[C@@H](O)C(=O)COP(O)(O)=O C[C@H](O)[C@H](O)[C@@H](O)C(=O)COP(O)(O)=O is A deoxyketohexose phosphate consisting of L-rhamnulose having a monophosphate group at the 1-position. It has the role of Escherichia coli metabolite . Its functional parent is L-rhamnulose . It is a conjugate acid of L-rhamnulose 1-phosphate(2-) . It is also related to or classified as deoxyketohexose phosphate .
The molecule C[C@@H]1OC(OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c2nc(N)[nH]c3=O)[C@@H](O)[C@H](O)C1=O C[C@@H]1OC(OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c2nc(N)[nH]c3=O)[C@@H](O)[C@H](O)C1=O is A GDP-hexose compound having 6-deoxy-L-xylo-hexopyranosyl-4-ulose as the hexose fragment. Its functional parent is GDP-L-fucose . It is also related to or classified as GDP-hexose  .
The molecule C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O)O is an anthocyanidin cation that is flavylium substituted at positions 3, 3', 4', 5 and 7 by hydroxy groups. It has a role as a metabolite, a neuroprotective agent and an antioxidant. It is a conjugate acid of a cyanidin(1-).
The molecule C1C=2[C@@]([C@H](C1)C(C)C)(CC[C@]3(C(C2)=C(CCC3)C)C)C C1C=2[C@@]([C@H](C1)C(C)C)(CC[C@]3(C(C2)=C(CCC3)C)C)C is guancastane diterpene from Candolleomyces candolleanus. It is also related to or classified as organic molecular entity .
The molecule O(C(=O)C(CCCC)CC)CCOCCOCCOC(=O)C(CCCC)CC O(C(=O)C(CCCC)CC)CCOCCOCCOC(=O)C(CCCC)CC is Triethylene glycol bis(2-ethylhexanoate). It is also related to or classified as fatty acid ester  .
The molecule C[C@@H]1OC(OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c2nc(N)[nH]c3=O)[C@H](O)[C@H](O)C1=O C[C@@H]1OC(OP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c2nc(N)[nH]c3=O)[C@H](O)[C@H](O)C1=O is A GDP-sugar having 4-dehydro-6-deoxy-L-mannose as the sugar component. Its functional parent is GDP-L-mannose . It is also related to or classified as GDP-sugar  .
The molecule C1=CC=CC=C1[C@@H](C)NC(C)=O C1=CC=CC=C1[C@@H](C)NC(C)=O is an N-(1-phenylethyl)acetamide that has R configuration. Its functional parent is (1R)-1-phenylethanamine . It is also related to or classified as N-(1-phenylethyl)acetamide  .
The molecule CCCC\C=C/CCCCCCCC(=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 CCCC\C=C/CCCCCCCC(=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 is an acyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of myristoleoyl-CoA; major species at pH 7.3. Its functional parent is myristoleic acid . It is also related to or classified as monounsaturated fatty acyl-CoA(4-)  .
The molecule C1CC(C2=C(C1)C3=C(N2)C=CC(=C3)Cl)C(=O)N is a member of the class of carbazoles that is 2,3,4,9-tetrahydro-1H-carbazole which is substituted at position 1 by an aminocarbohyl group and at position 6 by a chlorine. It is a member of carbazoles, a monocarboxylic acid amide and an organochlorine compound.
The molecule C(NC(CCNC(=O)[C@@H](C(COP([O-])(=O)[O-])(C)C)O)=O)CSC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O C(NC(CCNC(=O)[C@@H](C(COP([O-])(=O)[O-])(C)C)O)=O)CSC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O is S-(9Z,12Z,15Z-octadecatrienoyl)-4'-phosphopantetheine(2-). Its functional parent is alpha-linolenoyl-CoA(4-) . It is also related to or classified as S-acyl-4'-phosphopantetheine(2-)  .
The molecule O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C=C3OC=C(C(=O)C3=C(O)C2)C4=CC=C(O)C=C4)CO[C@@H]5OC[C@@](O)([C@H]5O)CO O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC=2C=C3OC=C(C(=O)C3=C(O)C2)C4=CC=C(O)C=C4)CO[C@@H]5OC[C@@](O)([C@H]5O)CO is Genistein 7-O-apiosyl-(1->6)-glucoside. It is also related to or classified as acrovestone  . It is also related to or classified as isoflavonoid .
The molecule [O-]C(=O)[C@@H]1CNCC[NH2+]1 [O-]C(=O)[C@@H]1CNCC[NH2+]1 is zwitterionic form of (S)-piperazine-2-carboxylic acid having an anionic carboxy group and a protonated 1-amino group. It is a conjugate acid of (S)-piperazine-2-carboxylate . It is also related to or classified as amino-acid zwitterion .
The molecule C1=CC=CC=C1C(C)NC(C)=O C1=CC=CC=C1C(C)NC(C)=O is A member of the class of acetamides resulting from the formal condensation of the amino group of 1-phenylethylamine with 1 mol eq. of acetic acid. Its functional parent is 1-phenylethylamine . It is also related to or classified as secondary carboxamide  . It is also related to or classified as acetamides .
The molecule O(C1C(O)C(O)C(OC1OC=2C(=[O+]C=3C(C2)=C(O)C=C(O)C3)C4=CC(OC)=C(O)C=C4)CO)C5OC(C(O)C(O)C5O)COC(=O)C=CC6=CC(O)=C(O)C=C6 O(C1C(O)C(O)C(OC1OC=2C(=[O+]C=3C(C2)=C(O)C=C(O)C3)C4=CC(OC)=C(O)C=C4)CO)C5OC(C(O)C(O)C5O)COC(=O)C=CC6=CC(O)=C(O)C=C6 is ({6-[(4,5-dihydroxy-2-{[7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-oxo-5H-chromen-3-yl]oxy}-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methyl)[3-(3,4-dihydroxyphenyl)-1-hydroxyprop-2-en-1-ylidene]oxidanium. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule C([C@@H](C(=O)[O-])N)[Se] is a selenocysteinate(1-). It is a conjugate base of a L-selenocysteine. It is a conjugate acid of a L-selenocysteinate(2-). It is an enantiomer of a D-selenocysteinate(1-).
The molecule CC\C=C/C\C=C/C\C=C/CCCCCCCC(=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 CC\C=C/C\C=C/C\C=C/CCCCCCCC(=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 is an octadecatrienoyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate functions of alpha-linolenoyl-CoA. It is also related to or classified as octadecatrienoyl-CoA(4-)  .
The molecule OS(O)(=O)=O.CNc1ccc(O)cc1.CNc1ccc(O)cc1 OS(O)(=O)=O.CNc1ccc(O)cc1.CNc1ccc(O)cc1 is the sulfate salt of 4-methylaminophenol. Its functional parent is 4-methylaminophenol . It is also related to or classified as organic sulfate salt .
The molecule O[C@@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O O[C@@H](COP(O)(O)=O)[C@@H](O)[C@H](O)[C@H](O)C(O)=O is A gulonic acid derivative that is L-gulonic acid carrying a phosphate group at position 6. It is also related to or classified as gulonic acid derivative .
The molecule [Na+].F[P-](F)(F)(F)(F)F [Na+].F[P-](F)(F)(F)(F)F is an inorganic sodium salt having hexafluorophosphate(1-) as the counterion. It is an electrolyte used in sodium-ion batteries. It is also related to or classified as inorganic sodium salt .
The molecule C(\[C@H](CCCC([O-])=O)O)=C\C=C\C=C\[C@@H](C\C=C/C=C/C(CC)=O)O C(\[C@H](CCCC([O-])=O)O)=C\C=C\C=C\[C@@H](C\C=C/C=C/C(CC)=O)O is an icosanoid anion resulting from the removal of a proton from the carboxy group of 18-oxoresolvin E1; major species at pH 7.3. It has the role of human xenobiotic metabolite . It is also related to or classified as long-chain fatty acid anion  . It is also related to or classified as hydroxy fatty acid anion , oxo fatty acid anion , icosanoid anion , polyunsaturated fatty acid anion .
The molecule C1=CC=CC=C1[C@H](C)NC(C)=O C1=CC=CC=C1[C@H](C)NC(C)=O is an N-(1-phenylethyl)acetamide that has S configuration. Its functional parent is (1S)-1-phenylethanamine . It is also related to or classified as N-(1-phenylethyl)acetamide  .
The molecule CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C is pelitinib. It has the role of protein kinase inhibitor . It is also related to or classified as nitrile  . It is also related to or classified as monocarboxylic acid amide  . It is also related to or classified as aminoquinoline  . It is also related to or classified as monochlorobenzenes .
The molecule CC1=CSC(=N1)NC(=O)C2=C(C3=CC=CC=C3N(C2=O)CC(C)C)O is a member of the class of quinolones that is the amide obtained from formal condensation of the carboxy group of 4-hydroxy-1-isobutyl-2-oxo-1,2-dihydroquinoline-3-carboxylic acid with the amino group of 2-amino-4-methyl-1,3-thiazole. It is a member of 1,3-thiazoles, a monocarboxylic acid amide, a monohydroxyquinoline and a quinolone.
The molecule O1C(=CC=C1[N+]([O-])=O)C(OC)=O O1C(=CC=C1[N+]([O-])=O)C(OC)=O is Methyl 5-nitro-2-furoate. Its functional parent is 2-furoic acid . It is also related to or classified as carboxylic ester  .
The molecule C(C=1C(=CC(=CC1)OC=2C=CC(=CC2)Cl)C(F)(F)F)(CN3N=CN=C3)(C)O C(C=1C(=CC(=CC1)OC=2C=CC(=CC2)Cl)C(F)(F)F)(CN3N=CN=C3)(C)O is an aromatic ether that is diphenyl ether substituted by a 2-hydroxy-1-(1H-1,2,4-triazol-1-yl)propan-2-yl group at position 1, trifluoromethyl group at position 2 and a chloro group at position 4. It is also related to or classified as tertiary alcohol  . It is also related to or classified as aromatic ether , triazoles , monochlorobenzenes , (trifluoromethyl)benzenes .
The molecule CSCC[C@H]([NH3+])C([O-])=O CSCC[C@H]([NH3+])C([O-])=O is zwitterionic form of L-methionine having a anionic carboxy group and a cationic amino group; major species at pH 7.3. It is also related to or classified as methionine zwitterion  .
The molecule OC[C@H]1O[C@H](O)[C@H](OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O OC[C@H]1O[C@H](O)[C@H](OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H]1O is A partially-defined glycan that is alpha-D-galactopyranose in which the hydroxy group at position 2 has been glycosylated to give the corresponding D-glucopyranoside. It is also related to or classified as partially-defined glycan , glycosylgalactose .
The molecule C1=CC=CC=C1[C@@H](C)[NH3+] C1=CC=CC=C1[C@@H](C)[NH3+] is an ammonium ion resulting from the protonation of the amino group of (R)-1-phenylethanamine; major microspecies at pH 7.3. It is a conjugate acid of (1R)-1-phenylethanamine . It is also related to or classified as ammonium ion derivative .
The molecule CCCCCCCC/C=C\\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\\CCCCCCCC is a phosphatidylcholine 36:2 in which the phosphatidyl acyl groups at positions 1 and 2 are both oleoyl. It is a 1-acyl-2-oleoyl-sn-glycero-3-phosphocholine betaine and a 1,2-di-octadecenoyl-sn-glycero-3-phosphocholine. It derives from an oleic acid. It is a conjugate base of a 1,2-dioleoyl-sn-glycero-3-phosphocholine(1+).
The molecule OC(CCCC=CCC=CCC=CCC=CCCCC(O)=O)C OC(CCCC=CCC=CCC=CCC=CCCCC(O)=O)C is 19(R)-hete. It is also related to or classified as hydroxy fatty acid , polyunsaturated fatty acid .
The molecule OCc1[nH]c(Cc2[nH]c(Cc3[nH]c(Cc4[nH]cc(CCC([O-])=O)c4CC([O-])=O)c(CCC([O-])=O)c3CC([O-])=O)c(CCC([O-])=O)c2CC([O-])=O)c(CCC([O-])=O)c1CC([O-])=O OCc1[nH]c(Cc2[nH]c(Cc3[nH]c(Cc4[nH]cc(CCC([O-])=O)c4CC([O-])=O)c(CCC([O-])=O)c3CC([O-])=O)c(CCC([O-])=O)c2CC([O-])=O)c(CCC([O-])=O)c1CC([O-])=O is octaanion of preuroporphyrinogen arising from global deprotonation of the eight carboxy groups; major species at pH 7.3. It has the role of Saccharomyces cerevisiae metabolite . It has the role of human metabolite . It is also related to or classified as linear tetrapyrrole anion .
The molecule C1=CC=CC=C1[C@H](C)[NH3+] C1=CC=CC=C1[C@H](C)[NH3+] is an ammonium ion resulting from the protonation of the amino group of (S)-1-phenylethanamine; major microspecies at pH 7.3. It is a conjugate acid of (1S)-1-phenylethanamine . It is also related to or classified as ammonium ion derivative .
The molecule CCCCS(=N)(=O)CC[C@H](N)C(O)=O CCCCS(=N)(=O)CC[C@H](N)C(O)=O is A 2-amino-4-(S-butylsulfonimidoyl)butanoic acid which has S-configuration. It is a inhibitor of gamma-glutamylcysteine synthetase and glutathione (GSH) biosynthesis and is capable of enhancing the apoptotic effects of several chemotherapeutic agents. It has the role of ferroptosis inducer . It has the role of EC 6.3.2.2 (glutamate--cysteine ligase) inhibitor . It is also related to or classified as 2-amino-4-(S-butylsulfonimidoyl)butanoic acid  .
The molecule C1[C@@H](N=C(S1)C2=NC3=C(S2)C=C(C=C3)O)C(=O)O is a 1,3-thiazolemonocarboxylic acid consisting of 3,5-dihydrothiophene-4-carboxylic acid having a 6-hydroxybenzothiazol-2-yl group at the 2-position. It has a role as a luciferin. It is a member of benzothiazoles, a 1,3-thiazolemonocarboxylic acid and an imidothioate. It is a conjugate acid of a Photinus luciferin(1-). It is an enantiomer of an ent-Photinus luciferin.
The molecule c1cc2C=Cc3cccc(c1)c23 c1cc2C=Cc3cccc(c1)c23 is A ortho- and peri-fused tricyclic hydrocarbon that occurs in coal tar. It is also related to or classified as ortho- and peri-fused polycyclic arene , acenaphthylenes , ortho- and peri-fused tricyclic hydrocarbon .
The molecule C(=O)([C@@H](N)CCCCNCCC(O)=O)O C(=O)([C@@H](N)CCCCNCCC(O)=O)O is n(6)-(2-Carboxyethyl)lysine with L configuration at the alpha carbon. It is also related to or classified as N(6)-(2-carboxyethyl)lysine  .
The molecule CC(C)[C@H](CO)Nc1nc(Nc2ccc(C(O)=O)c(Cl)c2)c2ncn(C(C)C)c2n1 CC(C)[C@H](CO)Nc1nc(Nc2ccc(C(O)=O)c(Cl)c2)c2ncn(C(C)C)c2n1 is purvalanol B. It has the role of protein kinase inhibitor . It is also related to or classified as purvalanol .
The molecule C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@]4([H])[C@@H](CCC(NCC([O-])=O)=O)C)[H])C)O)[H])C C1[C@@]2([C@]3(C[C@@H]([C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@]4([H])[C@@H](CCC(NCC([O-])=O)=O)C)[H])C)O)[H])C is A steroid sulfate oxoanion obtained by deprotonation of the carboxylic acid and sulfate functions of glycocholic acid 7-sulfate; major species at pH 7.3. Its functional parent is glycocholate . It is also related to or classified as steroid sulfate oxoanion .
The molecule C[C@H](O)[C@@H](O)[C@@H](O)C(=O)COP([O-])([O-])=O C[C@H](O)[C@@H](O)[C@@H](O)C(=O)COP([O-])([O-])=O is dianion of L-fuculose 1-phosphate arising from deprotonation of the phosphate OH groups; major species at pH 7.3. It is also related to or classified as organophosphate oxoanion .
The molecule C1=CC(=CC(=C1)N=NC2=C(C=C(C=C2)N)N)N=NC3=C(C=C(C=C3)N)N is a bis(azo) compound that is 1,1'-(1,3-phenylene)bis(diazene) in which both azene hydrogens are replaced by 2,4-diaminophenyl groups. A metachromatic dye which stains acid mucins yellow. It is also a constituent of Papanicolaou's EA solutions, used for cervical, and other smears. Its dihydrochloride salt is also a biological dye known as Bismark brown Y. It has a role as a fluorochrome and a histological dye. It is a bis(azo) compound, a member of azobenzenes, a tetramine and a substituted aniline.
The molecule ClC(F)(F)C(F)(F)F ClC(F)(F)C(F)(F)F is 1-Chloro-1,1,2,2,2-pentafluoroethane. It is also related to or classified as organochlorine compound  . It is also related to or classified as organofluorine compound  .
The molecule [H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC(=O)NCCS([O-])(=O)=O [H][C@@]12C[C@H](O)CC[C@]1(C)[C@@]1([H])C[C@H](O)[C@]3(C)[C@]([H])(CC[C@@]3([H])[C@]1([H])[C@H](O)C2)[C@H](C)CCC(=O)NCCS([O-])(=O)=O is an organosulfonate oxoanion that is the conjugate base of taurocholic acid. It has the role of Saccharomyces cerevisiae metabolite . It has the role of human metabolite .  It is also related to or classified as organosulfonate oxoanion  . It is also related to or classified as cholanic acid conjugate anion .
The molecule P(OC[C@@H](COCCCCCCCCCCCCCCCC)OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(=O)(OCC[N+](C)(C)C)[O-] P(OC[C@@H](COCCCCCCCCCCCCCCCC)OC(CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)(=O)(OCC[N+](C)(C)C)[O-] is A 1-O-alkyl-2-O-arachidonoyl-sn-glycero-3-phosphocholine where the alkyl group is specified as hexadecyl. It is also related to or classified as 1-O-alkyl-2-O-arachidonoyl-sn-glycero-3-phosphocholine  . It is also related to or classified as phosphatidylcholine O-36:4  .
The molecule NC(CCCCNCCC(O)=O)C(O)=O NC(CCCCNCCC(O)=O)C(O)=O is A lysine derivative in which the N(epsilon) of the amino acid carries a 2-carboxyethyl group. It is also related to or classified as lysine derivative , non-proteinogenic alpha-amino acid .
The molecule CCCCCCCCCCCCCCCCCCCCCCCC(CC(=O)O)O is a 3-hydroxy fatty acid that is hexacosanoic (cerotic) acid substituted at position 3 by a hydroxy group; a component of bacterial lipopolysaccharides. It is a 3-hydroxy monocarboxylic acid and a 3-hydroxy fatty acid. It derives from a hexacosanoic acid.
The molecule NC1=NC=NC2=C1N=C(O)N2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O NC1=NC=NC2=C1N=C(O)N2[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O is A purine ribonucleoside 5'-triphosphate that is ATP carrying a hydroxy group at position 8. Its functional parent is ATP . It is also related to or classified as purine ribonucleoside 5'-triphosphate .
The molecule COC(=O)[C@H]1[C@@H](C=CC2=C1C(=O)C3=C(C=C(C=C3O2)CO)O)O is a member of the class of xanthones that is methyl (1S)-2,9-dihydro-1H-xanthene-1-carboxylate substituted by hydroxy groups at positions 2 and 8, a hydroxymethyl group at position 6 and an oxo group at position 9. It has been isolated from the sea fan derived fungus Aspergillus sydowii. It has a role as an Aspergillus metabolite and an antioxidant. It is a member of xanthones, a member of phenols, an aromatic primary alcohol, a methyl ester and a secondary alcohol.
The molecule C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@@]4([C@@H](CCC([O-])=O)C)[H])[H])C)[H])C C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@@]4([C@@H](CCC([O-])=O)C)[H])[H])C)[H])C is A steroid sulfate oxoanion obtained by deprotonation of the carboxylic acid and sulfate functions of chenodeoxycholic acid 7-sulfate; major species at pH 7.3. Its functional parent is chenodeoxycholate . It is also related to or classified as steroid sulfate oxoanion .
The molecule O1C([C@H](O)C(O)C(O)[C@@H]1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C=4C=C(O[C@@H]5O[C@H]([C@H](O)C(O)C5O)C)C(O)=C(O)C4)CO O1C([C@H](O)C(O)C(O)[C@@H]1OC2=C(OC=3C(C2=O)=C(O)C=C(O)C3)C=4C=C(O[C@@H]5O[C@H]([C@H](O)C(O)C5O)C)C(O)=C(O)C4)CO is Myricetin 3-galactoside-3'-rhamnoside. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule C1[C@@]2([C@@](C(CC1)(C)C)(CC[C@]3([C@]2(CC[C@@]4([C@@]3(CC=5C4=C(C=C(C5O)O)C(O)=O)[H])C)[H])C)[H])C C1[C@@]2([C@@](C(CC1)(C)C)(CC[C@]3([C@]2(CC[C@@]4([C@@]3(CC=5C4=C(C=C(C5O)O)C(O)=O)[H])C)[H])C)[H])C is meroterpenoid from Scytonema sp. cyanobacteria. It is also related to or classified as organic molecular entity .
The molecule CCCCCC/C=C\\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])O is a 1-acyl-sn-glycero-3-phosphoethanolamine zwitterion obtained by transfer of a proton from the amino to the phosphate group of 1-(10Z-heptadecenoyl)-sn-glycero-3-phosphoethanolamine.
The molecule O1C(C(O)C(O)C(O)C1OC2=C(OC)C=3OC(=C(O)C(=O)C3C(O)=C2)C4=CC(OC)=C(O)C=C4)COC(=O)C O1C(C(O)C(O)C(O)C1OC2=C(OC)C=3OC(=C(O)C(=O)C3C(O)=C2)C4=CC(OC)=C(O)C=C4)COC(=O)C is Limocitrin 7-(6''-acetylglucoside). It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule [Li+].F[P-](F)(F)(F)(F)F [Li+].F[P-](F)(F)(F)(F)F is an inorganic lithium salt having hexafluorophosphate(1-) as the counterion. It is an electrolyte used in lithium-ion batteries. It is also related to or classified as lithium salt .
The molecule CC(=O)N[C@H]1[C@H](O)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@@]4(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O4)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@@H]1O CC(=O)N[C@H]1[C@H](O)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@@]4(C[C@H](O)[C@@H](NC(C)=O)[C@@H](O4)[C@H](O)[C@H](O)CO)C(O)=O)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@H](O)[C@@H]1O is A linear amino tetrasaccharide consisting of N-acetyl-alpha-neuraminyl, beta-D-galactosyl, N-acetyl-beta-glucosyl and N-acetyl-beta-D-galactosamine residues linked sequentially (2->6), (1->4) and (1->6). It is also related to or classified as glucosamine oligosaccharide , amino tetrasaccharide .
The molecule C[C@@H](C(=O)O)NC(=O)[C@@H](C)O[C@H]1[C@@H]([C@H](OC([C@@H]1NC(=O)C)O)CO)O is an L-alanine derivative consisting of an N-acetyl-D-muramoyl group attached to L-alanine via an amide linkage. It is a glyco-amino acid and a L-alanine derivative. It is a conjugate acid of a N-acetyl-D-muramoyl-L-alaninate.
The molecule C(O)C(=O)[C@@H](O)[C@@H](O)CO C(O)C(=O)[C@@H](O)[C@@H](O)CO is L-ribulose. It has the role of Escherichia coli metabolite . It is also related to or classified as ribulose  .
The molecule CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2 CC1(C)[C@H]2CC[C@]1(CS([O-])(=O)=O)C(=O)C2 is the R enantiomer of camphorsulfonate. It is also related to or classified as camphorsulfonate anion  .
The molecule [Na+].[Na+].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]OB1O[B-]2(O[H])OB(O[H])O[B-](O[H])(O1)O2 [Na+].[Na+].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]O[H].[H]OB1O[B-]2(O[H])OB(O[H])O[B-](O[H])(O1)O2 is A hydrate that is the octahydrate form of disodium tetraborate.  It is also related to or classified as mineral  . It is also related to or classified as hydrate .
The molecule [H][C@]1(CC[C@@H](C)[C@@]2([H])CC=C(C)C=C12)[C@@H](C)CCC=C(C)C [H][C@]1(CC[C@@H](C)[C@@]2([H])CC=C(C)C=C12)[C@@H](C)CCC=C(C)C is A diterpene from Leucophyllum frutescens. It has the role of plant metabolite .  It is also related to or classified as diterpene  . It is also related to or classified as hexahydronaphthalenes , olefinic compound .
The molecule COC1=C(C=C2C(=C1)[C@]34CCN5[C@]3(C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5)O)OC is a monoterpenoid indole alkaloid that is brucine in which the hydrogen at position 16 has been replaced by a hydroxy group. It has a role as a plant metabolite and a human xenobiotic metabolite. It is a delta-lactam, a hemiaminal, a monoterpenoid indole alkaloid, an organic heteroheptacyclic compound and an aromatic ether. It derives from a brucine.
The molecule C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@@]4([C@@H](CCC(NCCS(=O)(=O)[O-])=O)C)[H])[H])C)[H])C C1[C@@]2([C@]3(CC[C@]4([C@]([C@@]3([C@@H](C[C@@]2(C[C@@H](C1)O)[H])OS([O-])(=O)=O)[H])(CC[C@@]4([C@@H](CCC(NCCS(=O)(=O)[O-])=O)C)[H])[H])C)[H])C is A steroid sulfate oxoanion obtained by deprotonation of the carboxylic acid and sulfate functions of taurochenodeoxycholic acid 7-sulfate; major species at pH 7.3. Its functional parent is taurochenodeoxycholate . It is also related to or classified as steroid sulfate oxoanion .
The molecule CSCC[C@H]([NH3+])C(O)=O CSCC[C@H]([NH3+])C(O)=O is the L-enantiomer of methioninium. It has the role of Saccharomyces cerevisiae metabolite . It has the role of Escherichia coli metabolite . It is a conjugate acid of L-methionine . It is also related to or classified as methioninium  .
The molecule C1(=CC2=C(C(=C1C(=O)C(=C)C=3C=CC=CC3O)OC)OCO2)OC C1(=CC2=C(C(=C1C(=O)C(=C)C=3C=CC=CC3O)OC)OCO2)OC is A member of the class of benzodioxoles that is 1,3-benzodioxole which is substituted at positions 5 by  a 2-(2-hydroxyphenyl)-3-oxoprop-1-en-3-yl group and at positions 4 and 6 by methoxy groups. A very rare type of isoflavonoid-related 1,2-diaryl-2-propenone found in Dysphania glomulifera (red crumbweed) and D. littoralis, the enone moiety is particularly reactive, undergoing ready Michael addition of water and methanol. Biliatresone has been found to cause extrahepatic biliary atresia (obliteration or discontinuity of the extrahepatic biliary system, resulting in obstruction to bile flow) in a zebrafish model. It has the role of toxin . It has the role of plant metabolite . It is also related to or classified as phenols  .   It is also related to or classified as enone  . It is also related to or classified as aromatic ether , benzodioxoles , aromatic ketone .
The molecule COC(=O)[C@@H](N)CCCCN COC(=O)[C@@H](N)CCCCN is the L-lysyl ester formed by conjugating L-lysine with methanol. It is also related to or classified as L-lysyl ester .