Cucurbitacin IIb

Molecular Formula: C30H48O7


InChI: InChI=1/C30H48O7/c1-25(2,36)12-11-21(33)30(8,37)23-19(32)14-27(5)20-10-9-16-17(13-18(31)24(35)26(16,3)4)29(20,7)22(34)15-28(23,27)6/h9,17-20,23-24,31-32,35-37H,10-15H2,1-8H3/t17-,18+,19-,20+,23?,24-,27+,28u,29+,30+/m1/s1

InChIKey: InChIKey=VVBWBGOEAVGFTN-TZIDROGZBP
SMILES: CC1(C(C(CC2C1=CCC3C2(C(=O)CC4(C3(CC(C4C(C)(C(=O)CCC(C)(C)O)O)O)C)C)C)O)O)C

Names:
    CCRIS 7544
    Cucurbitacin IIb
    (2S,3R,8S,9R,10S,13R,14S,16R)-17-[(2R)-2,6-dihydroxy-6-methyl-3-oxo-heptan-2-yl]-2,3,16-trihydroxy-4,4,9,13,14-pentamethyl-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-11-one
    19-Norlanost-5-ene-11,22-dione, 2,3,16,20,25-pentahydroxy-9-methyl-, (2beta,3alpha,9beta,10alpha,16alpha)-
    23,24-Dihydrocucurbitacin F
    50298-90-3

Registries:
    PubChem CID 72421
    PubChem ID 214688