CALOTOXIN

Molecular Formula: C₂₉H₄₀O₁₀

InChI: InChI=1/C29H40O10/c1-14-23(32)24(33)29(35)25(37-14)38-20-10-16-3-4-19-18(27(16,13-30)11-21(20)39-29)5-7-26(2)17(6-8-28(19,26)34)15-9-22(31)36-12-15/h9,13-14,16-21,23-25,32-35H,3-8,10-12H2,1-2H3

InChIKey: InChIKey=LYSHVSOMKBORDM-UHFFFAOYAH
SMILES: CC1C(C(C2(C(O1)OC3CC4CCC5C(C4(CC3O2)C=O)CCC6(C5(CCC6C7=CC(=O)OC7)O)C)O)O)O

Names:
    BRN 0072512
    CALOTOXIN
    Card-20(22)-enolide, 3-((6-deoxy-beta-D-hexopyranos-2-ulos-1-yl)oxy)-2,14-dihydroxy-19-oxo-,(2alpha,3beta,5alpha)-
    HSDB 3468
    20304-49-8
    4-18-00-03126 (Beilstein Handbook Reference)
    5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-beta-D-hexopyranos-2-ulos-1-yl)oxy)-2-alpha,14-dihydroxy-19-oxo-
    5-alpha-Card-20(22)-enolide, 3-beta-((6-deoxy-beta-D-hexopyranos-2-ulos-1-yl)oxy)2-alpha,14-dihydroxy-19-oxo-

Registries:
    PubChem CID 30101
    PubChem ID 172286