Acetyl cinobufotalin

Molecular Formula: C₂₈H₃₆O₈

InChI: InChI=1/C28H36O8/c1-15(29)34-18-7-10-25(3)19-8-11-26(4)22(17-5-6-21(31)33-14-17)23(35-16(2)30)24-28(26,36-24)20(19)9-12-27(25,32)13-18/h5-6,14,18-20,22-24,32H,7-13H2,1-4H3/t18-,19u,20u,22-,23+,24+,25+,26+,27-,28+/m0/s1

InChIKey: InChIKey=OASAOOVBBYOWMZ-MTVLTLGCBL
SMILES: CC(=O)OC1CCC2(C3CCC4(C(C(C5C4(C3CCC2(C1)O)O5)OC(=O)C)C6=COC(=O)C=C6)C)C

Names:
    Acetyl cinobufotalin
    BRN 0070158
    BUFA-20,22-DIENOLIDE, 14,15-EPOXY-3,5,16-TRIHYDROXY-, 3,16-DIACETATE
    Cinobufotalin, acetyl-
    14,15-beta-Epoxy-3-beta,5,16-beta-trihydroxy-5-beta-bufa-20,22-dienolide 3,16-diacetate
    4-19-00-03010 (Beilstein Handbook Reference)
    4189-91-7

Registries:
    PubChem CID 20158
    PubChem ID 162992