anonymous041/ChEBI-Augmented huggingface dataset:
The molecule [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O is A sialotriaosylceramide that is N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine in which the acyl group on the sphingosine nitrogen is octanoyl. A synthetic modification of the natural ganglioside GM2. It is also related to or classified as sialotriaosylceramide .
The molecule O1[C@](C(O)[C@@H](O)[C@H](O)C1CO)(C2=C(O[C@@H]3OC([C@@H](O)[C@H](O)C3O)COC(=O)/C=C/C4=CC(OC)=C(O)C=C4)C=C5OC(=CC(=O)C5=C2O)C6=CC=C(O)C=C6)[H] O1[C@](C(O)[C@@H](O)[C@H](O)C1CO)(C2=C(O[C@@H]3OC([C@@H](O)[C@H](O)C3O)COC(=O)/C=C/C4=CC(OC)=C(O)C=C4)C=C5OC(=CC(=O)C5=C2O)C6=CC=C(O)C=C6)[H] is Isovitexin 7-O-beta-[6'''-O-(E)-p-feruloyl]glucoside. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule O=C1[C@@]2([C@]([C@]3([C@@]([C@@]4(C(CC3)=C[C@H](O)CC4)C)(CC2)[H])[H])(CC1)[H])C O=C1[C@@]2([C@]([C@]3([C@@]([C@@]4(C(CC3)=C[C@H](O)CC4)C)(CC2)[H])[H])(CC1)[H])C is 3alpha-Hydroxy-androst-4-ene-17-one. It has the role of androgen . It is also related to or classified as 3-hydroxy steroid .
The molecule [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O is A sialotriaosylceramide that is N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine in which the acyl group on the sphingosine nitrogen is hexadecanoyl. A synthetic modification of the natural ganglioside GM2. It is also related to or classified as sialotriaosylceramide .
The molecule [H+].OC(=O)CCCN1CCC(CC1)O[C@@H](c1ccc(Cl)cc1)c1ccccn1 [H+].OC(=O)CCCN1CCC(CC1)O[C@@H](c1ccc(Cl)cc1)c1ccccn1 is an organic cation that is the conjugate acid of bepotastine. It is a conjugate acid of bepotastine . It is also related to or classified as organic cation .
The molecule O1C(C(O)C(O)C(O)C1OC2=CC=3OC(CC(=O)C3C=C2)C4=CC=C(OC)C=C4)C O1C(C(O)C(O)C(O)C1OC2=CC=3OC(CC(=O)C3C=C2)C4=CC=C(OC)C=C4)C is 4'-Methylliquiritigenin 7-rhamnoside. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)[C@H](O)C C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)[C@H](O)C is A dipeptide obtained by formal condensation of the carboxy group of L-tyrosine with the amino group of L-threonine. Its functional parent is L-threonine . Its functional parent is L-tyrosine . It is also related to or classified as dipeptide  .
The molecule O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=CC=C(C3OC=4C(C(=O)C3)=C(O)C=C(O)C4)C=C2)CO O1[C@@H]([C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC2=CC=C(C3OC=4C(C(=O)C3)=C(O)C=C(O)C4)C=C2)CO is Naringenin 4'-O-glucoside. It is also related to or classified as glycoside  . It is also related to or classified as flavonoids .
The molecule C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CO C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CO is A dipeptide obtained by formal condensation of the carboxy group of L-tyrosine with the amino group of L-serine. Its functional parent is L-serine . Its functional parent is L-tyrosine . It is also related to or classified as dipeptide  .
The molecule O[Bi]1Oc2cc(cc(O)c2O1)C(O)=O O[Bi]1Oc2cc(cc(O)c2O1)C(O)=O is bismuth subgallate. It has the role of astringent . It is also related to or classified as bismuth coordination entity .
The molecule [H]C(=O)[C@H](NS([O-])(=O)=O)[C@@H](O)[C@H](O)[C@H](O)COS([O-])(=O)=O [H]C(=O)[C@H](NS([O-])(=O)=O)[C@@H](O)[C@H](O)[C@H](O)COS([O-])(=O)=O is dianion of 2-N,6-O-disulfo-D-glucosamine arising from deprotonation of both sulfate OH groups; major species at pH 7.3. It is also related to or classified as organosulfate oxoanion  .
The molecule O1CC(=NC=C1)C(O)=O O1CC(=NC=C1)C(O)=O is Codopiloic acid. It is also related to or classified as azetidine-2-carboxylic acid  . It is also related to or classified as organonitrogen heterocyclic compound .
The molecule C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N2[C@H](C(=O)O)CCC2 C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N2[C@H](C(=O)O)CCC2 is A dipeptide obtained by formal condensation of the carboxy group of L-tyrosine with the amino group of L-proline. Its functional parent is L-proline . Its functional parent is L-tyrosine . It is also related to or classified as dipeptide  .
The molecule O(C(=O)CCCCCCCCCCCCC=CCCCCC)C/C(/C)=C\C#N O(C(=O)CCCCCCCCCCCCC=CCCCCC)C/C(/C)=C\C#N is 3-O-14,15-Eicosylenoyl-1-cyano-2-methyl-1,2-propene. It is also related to or classified as nitrile  . It is also related to or classified as fatty acid ester  .
The molecule O[C@H]1[C@@]([C@@]2([C@](C3[C@](CC2)([C@@]4(C(=CC3OC)C(C(O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC4)(C)C)[H])C)(C1)C)C)([C@@H](CCC=C(C)C)C)[H] O[C@H]1[C@@]([C@@]2([C@](C3[C@](CC2)([C@@]4(C(=CC3OC)C(C(O[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)CC4)(C)C)[H])C)(C1)C)C)([C@@H](CCC=C(C)C)C)[H] is Hebevinoside IV.  It is also related to or classified as glycoside  . It is also related to or classified as cucurbitacin .
The molecule C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CC(=O)O C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CC(=O)O is A dipeptide obtained by formal condensation of the carboxy group of L-tyrosine with the amino group of L-aspartic acid. Its functional parent is L-aspartic acid . Its functional parent is L-tyrosine . It is also related to or classified as dipeptide  .
The molecule [Cr++] [Cr++] is chromium(2+). It is also related to or classified as monoatomic dication  . It is also related to or classified as chromium cation , divalent metal cation .
The molecule [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCC=CCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCC=CCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O is A sialotriaosylceramide that is N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine in which the acyl group on the sphingosine nitrogen is octadec-9-enoyl. A synthetic modification of the natural ganglioside GM2. It is also related to or classified as sialotriaosylceramide .
The molecule [H][C@]12CN3C(=O)CCC[C@]3([H])[C@]([H])(C[NH+]3CCCC[C@@]13[H])C2 [H][C@]12CN3C(=O)CCC[C@]3([H])[C@]([H])(C[NH+]3CCCC[C@@]13[H])C2 is an organic cation that is the conjugate acid of lupanine, arising from protonation of the tertiary amino function; major species at pH 7.3. It is a conjugate acid of lupanine . It is also related to or classified as organic cation , ammonium ion derivative .
The molecule CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)cc(C)c2O1 CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CCc2c(C)c(O)cc(C)c2O1 is A tocopherol in which the chroman-6-ol core is substituted by methyl groups at positions 5 and 8. While it is found in low concentrations in many vegetable oils, only cottonseed oil contains significant amounts. It has the role of plant metabolite . It has the role of food component . It is also related to or classified as tocopherol  . It is also related to or classified as vitamin E .
The molecule C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CC(=O)N C(=O)([C@@H](N)CC=1C=CC(=CC1)O)N[C@H](C(=O)O)CC(=O)N is A dipeptide obtained by formal condensation of the carboxy group of L-tyrosine with the amino group of L-asparagine. Its functional parent is L-asparagine . Its functional parent is L-tyrosine . It is also related to or classified as dipeptide  .
The molecule Oc1ccc(cc1)-c1coc2cc([O-])ccc2c1=O Oc1ccc(cc1)-c1coc2cc([O-])ccc2c1=O is A flavonoid oxoanion obtained by deprotonation of the 7-hydroxy group of daidzein. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). It has the role of EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor . It has the role of antineoplastic agent . It has the role of plant metabolite . It has the role of phytoestrogen . It is also related to or classified as flavonoid oxoanion .
The molecule OC(=O)CC(=O)Nc1ccc(Cl)c(Cl)c1 OC(=O)CC(=O)Nc1ccc(Cl)c(Cl)c1 is A dicarboxylic acid monoamide that is the mono-(3,4-dichloroanilide) of malonic acid. Its functional parent is malonamic acid . It is a conjugate acid of N-(3,4-dichlorophenyl)malonamate . It is also related to or classified as dichlorobenzene  . It is also related to or classified as monocarboxylic acid , dicarboxylic acid monoamide .
The molecule [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O [C@@]1(O[C@]([C@H](NC(=O)C)[C@H](C1)O)([C@@H]([C@H](O)CO)O)[H])(C(O)=O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@@H]3[C@H](O[C@@H](OC[C@@H]([C@@H](/C=C/CCCCCCCCCCCCC)O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[C@@H]([C@H]3O)O)CO)CO)O[C@H]4[C@@H]([C@H]([C@@H](O)[C@H](O4)CO)O)NC(C)=O is A sialotriaosylceramide that is N-acetyl-beta-D-galactosaminyl-(1->4)-alpha-N-acetylneuraminosyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-N-acylsphingosine in which the acyl group on the sphingosine nitrogen is tetracosanoyl. A synthetic modification of the natural ganglioside GM2. It is also related to or classified as sialotriaosylceramide .
The molecule NC(=O)CCC([NH3+])C(O)=O NC(=O)CCC([NH3+])C(O)=O is an alpha-amino-acid cation that is the conjugate acid of glutamine, arising from protonation of the amino group. It is a conjugate acid of glutamine . It is also related to or classified as alpha-amino-acid cation .
The molecule O[C@@H]1[C@@]2([C@]([C@]3([C@@]([C@@]4(C(=CC3)C[C@@H](O)CC4)C)(CC2)[H])[H])(CC1=O)[H])C O[C@@H]1[C@@]2([C@]([C@]3([C@@]([C@@]4(C(=CC3)C[C@@H](O)CC4)C)(CC2)[H])[H])(CC1=O)[H])C is 16-Oxoandrostenediol. It has the role of androgen . It is also related to or classified as 3-hydroxy steroid .
The molecule C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)[C@@H](C)O C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)[C@@H](C)O is A dipeptide obtained by formal condensation of the carboxy group of L-tryptophan with the amino group of L-threonine. Its functional parent is L-tryptophan . Its functional parent is L-threonine . It is also related to or classified as dipeptide  .
The molecule O(C1=CC=C(CC(=O)C(OC)=O)C=C1)C O(C1=CC=C(CC(=O)C(OC)=O)C=C1)C is Methyl 3-(4-methoxyphenyl)-2-oxopropanoate. Its functional parent is pyruvic acid . It is also related to or classified as 2-oxo monocarboxylic acid  .
The molecule C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N3[C@H](C(=O)O)CCC3 C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N3[C@H](C(=O)O)CCC3 is A dipeptide obtained by formal condensation of the carboxy group of L-tryptophan with the amino group of L-proline. Its functional parent is L-tryptophan . Its functional parent is L-proline . It is also related to or classified as dipeptide  .
The molecule S(OC1C(O)C(OC(OC2=CC(=CC(O)=C2)/C=C\C3=CC=C(O)C=C3)C1O)CO)(O)(=O)=O S(OC1C(O)C(OC(OC2=CC(=CC(O)=C2)/C=C\C3=CC=C(O)C=C3)C1O)CO)(O)(=O)=O is (Z)-Resveratrol 3-(3''-sulfoglucoside). It is also related to or classified as glycoside  . It is also related to or classified as stilbenoid .
The molecule C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)[C@@H](C)CC C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-tryptophan with the amino group of L-isoleucine. Its functional parent is L-tryptophan . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .
The molecule C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)CC(=O)N C(=O)([C@@H](N)CC1=CNC2=C1C=CC=C2)N[C@H](C(=O)O)CC(=O)N is A dipeptide obtained by formal condensation of the carboxy group of L-tryptophan with the amino group of L-asparagine. Its functional parent is L-tryptophan . Its functional parent is L-asparagine . It is also related to or classified as dipeptide  .
The molecule C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CCCC[NH3+])NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)OC(OP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@@H]1NC(C)=O)C([O-])=O)C([O-])=O C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CCCC[NH3+])NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)O[C@H]1[C@H](O)[C@@H](CO)OC(OP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@@H]1NC(C)=O)C([O-])=O)C([O-])=O is trianion of UDP-N-acetylmuramoyl-L-alanyl-gamma-D-glutamyl-L-lysyl-D-alanyl-D-alanine(3-) arising from deprotonation of diphosphate and carboxy groups and protonation of the side-chain amino group of the lysyl residue; major species at pH 7.3. It is also related to or classified as nucleotide-sugar oxoanion , peptide anion .
The molecule OC(CCCCCC(O)=O)/C=C/C=C\C/C=C\C=C\C(O)C/C=C\CC OC(CCCCCC(O)=O)/C=C/C=C\C/C=C\C=C\C(O)C/C=C\CC is 7(S),17(S)-dihydroxy-8(E),10(Z),13(Z),15(E),19(Z)-Docosapentaenoic Acid. It is also related to or classified as very long-chain fatty acid  .
The molecule O1C2(C1(C(=O)C=3C(C2=O)=CC=CC3)C4=CC=CC=C4)CC(O)=O O1C2(C1(C(=O)C=3C(C2=O)=CC=CC3)C4=CC=CC=C4)CC(O)=O is 2-Carboxymethyl-3-phenyl-2,3-epoxy-1,4-naphthoquinone. It is also related to or classified as benzenes , naphthalenes , ring assembly .
The molecule C(=O)([C@@H](N)[C@H](O)C)N[C@H](C(=O)O)[C@@H](C)CC C(=O)([C@@H](N)[C@H](O)C)N[C@H](C(=O)O)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-threonine with the amino group of L-isoleucine. Its functional parent is L-threonine . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .
The molecule O[C@H]1[C@@]2([C@]([C@]3([C@@]([C@@]4([C@](CC3)(C[C@H](O)CC4)[H])C)(CC2)[H])[H])(CC1)[H])C O[C@H]1[C@@]2([C@]([C@]3([C@@]([C@@]4([C@](CC3)(C[C@H](O)CC4)[H])C)(CC2)[H])[H])(CC1)[H])C is 3alpha,17alpha-Dihydroxy-5beta-androstane. It has the role of androgen . It is also related to or classified as 3-hydroxy steroid .
The molecule O1C(C=CC=2C=3N(C4=C(C(=O)C3C(O)=CC12)C=CC(OC)=C4O)C)(C)C O1C(C=CC=2C=3N(C4=C(C(=O)C3C(O)=CC12)C=CC(OC)=C4O)C)(C)C is 2',2'-Dimethyl(pyrano-5',6':3:4)-1,5-dihydroxy-6-methoxy-10-methylacridone. Its functional parent is acridone . It is also related to or classified as acridines .
The molecule C(=O)([C@@H](N)CO)N[C@H](C(=O)O)CC1=CNC2=C1C=CC=C2 C(=O)([C@@H](N)CO)N[C@H](C(=O)O)CC1=CNC2=C1C=CC=C2 is A dipeptide obtained by formal condensation of the carboxy group of L-serine with the amino group of L-tryptophan. Its functional parent is L-tryptophan . Its functional parent is L-serine . It is also related to or classified as dipeptide  .
The molecule O=C(CCc1ccccc1)c1ccccc1 O=C(CCc1ccccc1)c1ccccc1 is A member of the class of dihydrochalcones that is acetophenone in which one of the hydrogens of the methyl group is replaced by a benzyl group. It has the role of plant metabolite . It is also related to or classified as dihydrochalcones .
The molecule [C@@H](NC([C@H]1NCCC1)=O)(C(=O)O)CCSC [C@@H](NC([C@H]1NCCC1)=O)(C(=O)O)CCSC is A dipeptide obtained by formal condensation of the carboxy group of L-proline with the amino group of L-methionine. Its functional parent is L-methionine . Its functional parent is L-proline . It is also related to or classified as dipeptide  .
The molecule [C@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)(COP(OCC(COP(OC[C@H](OC(=O)CCCCCCCCCCCCCCC)COC(CCCCCCC/C=C\CCCCCCCC)=O)([O-])=O)O)([O-])=O)COC(CCCCCCC/C=C\CCCCCCCC)=O [C@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)(COP(OCC(COP(OC[C@H](OC(=O)CCCCCCCCCCCCCCC)COC(CCCCCCC/C=C\CCCCCCCC)=O)([O-])=O)O)([O-])=O)COC(CCCCCCC/C=C\CCCCCCCC)=O is 1,1',2-trioleoyl-2'-palmitoyl-cardiolipin(2-). Its functional parent is oleate . Its functional parent is hexadecanoate . It is also related to or classified as cardiolipin 70:3(2-)  .
The molecule O(C(C(O)C)C1=C(OC(=O)C(CC)C)C=CC(OC)=C1)CC O(C(C(O)C)C1=C(OC(=O)C(CC)C)C=CC(OC)=C1)CC is 2-(1-Ethoxy-2-hydroxy)propyl-4-methoxyphenol-2-methyl-butyrate. It is also related to or classified as phenols  . It is also related to or classified as benzoate ester .
The molecule C(=O)([C@@H](N)CC1=CC=CC=C1)N[C@H](C(=O)O)CCCCN C(=O)([C@@H](N)CC1=CC=CC=C1)N[C@H](C(=O)O)CCCCN is A dipeptide obtained by formal condensation of the carboxy group of L-phenylalanine with the amino group of L-lysine. Its functional parent is L-phenylalanine . Its functional parent is L-lysine . It is also related to or classified as dipeptide  .
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-])=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-])=O)[C@@H](O)[C@H]2O)cc1 is trianion of 5,6,7,8-tetrahydromethanopterin arising from deprotonation of carboxy and phosphate OH groups; major species at pH 7.3. It is also related to or classified as dicarboxylic acid dianion  . It is also related to or classified as organophosphate oxoanion .
The molecule C(=O)([C@@H](N)CCSC)N[C@H](C(=O)O)CC(=O)N C(=O)([C@@H](N)CCSC)N[C@H](C(=O)O)CC(=O)N is A dipeptide obtained by formal condensation of the carboxy group of L-methionine with the amino group of L-asparagine. Its functional parent is L-methionine . Its functional parent is L-asparagine . It is also related to or classified as dipeptide  .
The molecule [H][C@]12C[C@@H](O)[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CCCC(C)C)[C@@]1(C)CCC(=O)C2 [H][C@]12C[C@@H](O)[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@@]34[H])[C@H](C)CCCC(C)C)[C@@]1(C)CCC(=O)C2 is A 3-oxo-5beta-steroid that is 5beta-cholestan-3-one bearing an additional hydroxy substituent at position 7alpha . It has the role of mouse metabolite . It has the role of human metabolite . It is also related to or classified as 3-oxo-5beta-steroid  . It is also related to or classified as 7alpha-hydroxy steroid  .
The molecule [H]OCl(=O)=O [H]OCl(=O)=O is chloric acid. It is a conjugate acid of chlorate . It is also related to or classified as chlorine oxoacid .
The molecule N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@@H](C)CC N[C@H](C(=O)N[C@H](C(=O)O)[C@H](O)C)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-isoleucine with the amino group of L-threonine. Its functional parent is L-threonine . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .
The molecule [H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4(O)C[C@@H](O)CC[C@]4(C=O)[C@@]3([H])CC[C@]12C)C1=COC(=O)C=C1 [H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4(O)C[C@@H](O)CC[C@]4(C=O)[C@@]3([H])CC[C@]12C)C1=COC(=O)C=C1 is hellebrigenin. It has the role of autophagy inducer . It has the role of antineoplastic agent . It has the role of apoptosis inducer . It has the role of antileishmanial agent . It has the role of animal metabolite . It has the role of plant metabolite . Its functional parent is 5beta-bufanolide .   It is also related to or classified as 3beta-hydroxy steroid  . It is also related to or classified as steroid aldehyde , steroid lactone , 14beta-hydroxy steroid , 19-oxo steroid , 5beta-hydroxy steroid .
The molecule O=[Bi]OC(=O)O[Bi]=O O=[Bi]OC(=O)O[Bi]=O is bismuth subcarbonate. Its functional parent is carbonic acid . It is also related to or classified as bismuth coordination entity , one-carbon compound .
The molecule N[C@H](C(=O)N[C@H](C(=O)O)CCCCN)[C@@H](C)CC N[C@H](C(=O)N[C@H](C(=O)O)CCCCN)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-isoleucine with the amino group of L-lysine. Its functional parent is L-isoleucine . Its functional parent is L-lysine . It is also related to or classified as dipeptide  .
The molecule [H]OB(O[H])O[H] [H]OB(O[H])O[H] is boric acid. It has the role of astringent . It is a conjugate acid of dihydrogenborate . It is also related to or classified as boric acids .
The molecule [H][Sn](CCCC)(CCCC)CC(O)CC [H][Sn](CCCC)(CCCC)CC(O)CC is A 1-stannylbutan-2-ol carrying two butyl groups on the tin atom. It is also related to or classified as 1-stannylbutan-2-ols .
The molecule N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)[C@@H](C)CC N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-isoleucine with the amino group of L-aspartic acid. Its functional parent is L-aspartic acid . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .
The molecule O(C(C(O)C)C1=C(O)C=CC(OC)=C1)CC O(C(C(O)C)C1=C(O)C=CC(OC)=C1)CC is 2-(1-Ethoxy-2-hydroxy)propyl-4-methoxyphenol. It is also related to or classified as phenols  . It is also related to or classified as methoxybenzenes .
The molecule [V+] [V+] is vanadium(1+). It is also related to or classified as monoatomic monocation  . It is also related to or classified as vanadium cation .
The molecule C(=O)([C@@H](N)CC=1N=CNC1)N[C@H](C(=O)O)CC=2C=CC=CC2 C(=O)([C@@H](N)CC=1N=CNC1)N[C@H](C(=O)O)CC=2C=CC=CC2 is A dipeptide obtained by formal condensation of the carboxy group of L-histidine with the amino group of L-phenylalanine. Its functional parent is L-histidine . Its functional parent is L-phenylalanine . It is also related to or classified as dipeptide  .
The molecule C(=O)([C@@H](N)CC=1N=CNC1)N[C@H](C(=O)O)[C@@H](C)CC C(=O)([C@@H](N)CC=1N=CNC1)N[C@H](C(=O)O)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-histidine with the amino group of L-isoleucine. Its functional parent is L-histidine . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .
The molecule [H][C@]12NC3=C(N[C@@]1([H])C1=C(S[Mo]4(=O)(SC5=C(S4)[C@]4([H])NC6=C(N[C@]4([H])O[C@@H]5COP([O-])(=O)OP([O-])(=O)OC[C@H]4O[C@H]([C@H](O)[C@@H]4O)N4C=NC5=C4N=C(N)NC5=O)N=C(N)NC6=O)S1)[C@@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC4=C1N=C(N)NC4=O)O2)C(=O)NC(N)=N3 [H][C@]12NC3=C(N[C@@]1([H])C1=C(S[Mo]4(=O)(SC5=C(S4)[C@]4([H])NC6=C(N[C@]4([H])O[C@@H]5COP([O-])(=O)OP([O-])(=O)OC[C@H]4O[C@H]([C@H](O)[C@@H]4O)N4C=NC5=C4N=C(N)NC5=O)N=C(N)NC6=O)S1)[C@@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC4=C1N=C(N)NC4=O)O2)C(=O)NC(N)=N3 is an organophosphate oxoanion arising from deprotonation of the diphosphate OH groups of molybdate-bis(molybdopterin guanine dinucleotide); major species at pH 7.3. It is also related to or classified as Mo-molybdopterin cofactor , organophosphate oxoanion .
The molecule [C@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)(COP(OCC(COP(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCCC)COC(CCCCCCC/C=C\CCCCCCCC)=O)([O-])=O)O)([O-])=O)COC(CCCCCCC/C=C\CCCCCCCC)=O [C@H](OC(CCCCCCC/C=C\CCCCCCCC)=O)(COP(OCC(COP(OC[C@H](OC(=O)CCCCCCC/C=C\CCCCCC)COC(CCCCCCC/C=C\CCCCCCCC)=O)([O-])=O)O)([O-])=O)COC(CCCCCCC/C=C\CCCCCCCC)=O is 1,1',2-trioleoyl-2'-palmitoleoyl-cardiolipin(2-). Its functional parent is oleate . Its functional parent is palmitoleate . It is also related to or classified as cardiolipin 70:4(2-)  .
The molecule C(=O)([C@@H](N)CCC(=O)O)N[C@H](C(=O)O)[C@@H](C)CC C(=O)([C@@H](N)CCC(=O)O)N[C@H](C(=O)O)[C@@H](C)CC is A dipeptide obtained by formal condensation of the carboxy group of L-glutamic acid with the amino group of L-isoleucine. Its functional parent is L-glutamic acid . Its functional parent is L-isoleucine . It is also related to or classified as dipeptide  .