Compound Details

 Compound-ID 6249
 Common Name Chenodeoxycholate
 Synonyms 3alpha,7alpha-Dihydroxy-5beta-cholanate
3alpha,7alpha-Dihydroxy-5beta-cholanic acid
Chenodeoxycholic acid
 InChI InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/p-1/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
 SMILES [H]C13(CC(O)CCC1(C)C4([H])(CCC2(C)(C([H])(CCC2([H])C4([H])(C(O)C3))C(C)CCC(O)=O)))
 External Links
 KEGG-COMPOUND-ID C02528
 PUBCHEM-ID 5536
 ChEBI-ID 16755
36234
 REACTOME-ID 194096
 METACYC-ID CPD-15189
 METANETX-ID MNXM727183
 BioModels 16755
36234


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