Digitoxigenon

Molecular Formula: C23H32O4


InChI: InChI=1/C23H32O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15,17-19,26H,3-10,12-13H2,1-2H3/t15-,17-,18u,19u,21+,22-,23+/m1/s1

InChIKey: InChIKey=REJBTXQSIQFRRE-CMXUIEJSBW
SMILES: CC12CCC(=O)CC1CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C

Names:
    Card-20(22)-enolide, 14-hydroxy-3-oxo-, (5-beta)-
    Digitoxigenone
    Digitoxigenon
    EINECS 214-159-0
    (5beta)-14-Hydroxy-3-oxocard-20(22)-enolide
    14-Hydroxy-3-oxo-5-beta-card-20(22)-enolide
    3-Dehydrodigitoxigenin
    3-Digitoxigenone
    3-Ketodigitoxigenin
    3-Oxodigitoxigenin
    4-[(5R,10S,13R,14S,17S)-14-hydroxy-10,13-dimethyl-3-oxo-2,4,5,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-5H-furan-2-one

Registries:
    PubChem CID 14197
    PubChem ID 157482