23-Methyl-ursodeoxycholic acid (.alpha.)

Molecular Formula: C₂₅H₄₀O₅

InChI: InChI=1/C25H40O5/c1-13(9-14(2)23(29)30)17-5-6-18-22-19(12-21(28)25(17,18)4)24(3)8-7-16(26)10-15(24)11-20(22)27/h13-20,22,26-27H,5-12H2,1-4H3,(H,29,30)/f/h29H

InChIKey: InChIKey=DZHVFBBPRZSBGN-PKRZOPRNCX
SMILES: CC(CC(C)C(=O)O)C1CCC2C1(C(=O)CC3C2C(CC4C3(CCC(C4)O)C)O)C

Names:
    AIDS-141735
    AIDS141735
    NSC657953
    23-Methyl-ursodeoxycholic acid (.alpha.)
    4-(3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)-2-methyl-pentanoic acid

Registries:
    PubChem CID 495540
    PubChem ID 237684