Hellebrigenin

Molecular Formula: C₂₄H₃₂O₆

InChI: InChI=1/C24H32O6/c1-21-8-5-18-19(6-10-23(28)12-16(26)4-9-22(18,23)14-25)24(21,29)11-7-17(21)15-2-3-20(27)30-13-15/h2-3,13-14,16-19,26,28-29H,4-12H2,1H3/t16-,17+,18u,19u,21+,22-,23-,24-/m0/s1

InChIKey: InChIKey=TVKPTWJPKVSGJB-VDCDNAAWBX
SMILES: CC12CCC3C(C1(CCC2C4=COC(=O)C=C4)O)CCC5(C3(CCC(C5)O)C=O)O

Names:
    BRN 0056259
    Bufa-20,22-dienolide, 3,5,14-trihydroxy-19-oxo-, (3beta,5beta)-
    Bufotalidin
    EINECS 207-368-3
    Gellebrigenin
    Hellebrigenin
    NSC 89594
    (3S,5S,10R,13R,14S,17S)-3,5,14-trihydroxy-13-methyl-17-(6-oxopyran-3-yl)-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-10-carbaldehyde
    19-Oxo-3-beta,5,14-trihydroxy-5-beta-bufa-20,22-dienolide
    5-beta-BUFA-20,22-DIENOLIDE, 3-beta,5,14-TRIHYDROXY-19-OXO-
    5-18-05-00180 (Beilstein Handbook Reference)

Registries:
    PubChem CID 10068
    PubChem ID 153302