CINOBUFAGIN-3-HEMISUCCINATE

Molecular Formula: C30H38O9


InChI: InChI=1/C30H38O9/c1-16(31)37-26-25(17-4-8-23(34)36-15-17)29(3)13-11-20-21(30(29)27(26)39-30)6-5-18-14-19(10-12-28(18,20)2)38-24(35)9-7-22(32)33/h4,8,15,18-21,25-27H,5-7,9-14H2,1-3H3,(H,32,33)/t18-,19+,20+,21-,25+,26-,27-,28+,29-,30-/m1/s1/f/h32H

InChIKey: InChIKey=GFKJGXMLXPRSOS-SKWYNGNGDV
SMILES: CC(=O)OC1C(C2(CCC3C(C24C1O4)CCC5C3(CCC(C5)OC(=O)CCC(=O)O)C)C)C6=COC(=O)C=C6

Names:
    Bufa-20,22-dienolide, 16-(acetyloxy)-3-(3-carboxy-1-oxopropoxy)-14,15-epoxy-, (3.beta., 5.beta.,15.beta.,16.beta.)-
    CINOBUFAGIN-3-HEMISUCCINATE
    NSC234204
    36615-12-0

Registries:
    PubChem CID 11969464
    PubChem ID 133577