3-oxo-5beta-cholan-24-oate

Molecular Formula: C₂₄H₃₇O₃^-

InChI: InChI=1/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-16,18-21H,4-14H2,1-3H3,(H,26,27)/p-1/t15-,16-,18+,19-,20+,21+,23+,24-/m1/s1/fC24H37O3/q-1

InChIKey: InChIKey=KIQFUORWRVZTHT-ZSNRZPEGDN
SMILES: [H][C@]12CC[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)CCC([O-])=O)[C@@]4(C)CC[C@]3([H])[C@@]1(C)CCC(=O)C2

Names:
    CHEBI:11867
    (4R)-4-[(5R,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-3-oxo-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
    3-Oxo-5beta-cholanate
    3-oxo-5beta-cholanate
    3-oxo-5beta-cholan-24-oate

Registries:
    PubChem CID 9548901
    ChEBI 11867
    PubChem ID 14718470