3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate

Molecular Formula: C₂₄H₃₈O₄

InChI: InChI=1/C24H38O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h5-6,14-21,25-26H,4,7-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1/f/h27H

InChIKey: InChIKey=LNOFKAWCANXKAC-WHIRJYKVDN
SMILES: CC(CCC(=O)O)C1CCC2C1(C(CC3C2C=CC4C3(CCC(C4)O)C)O)C

Names:
    C11637
    (4R)-4-[(3R,5S,8S,9S,10R,12S,13R,14S,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
    3alpha,12alpha-Dihydroxy-5beta-chol-6-enoate

Registries:
    PubChem CID 443323
    PubChem ID 13802