APHANASTATIN

Molecular Formula: C35H46O13


InChI: InChI=1/C35H46O13/c1-8-15(2)29(42)47-30-31(5)20-12-21(38)33(7)25(34(20,14-44-30)27(41)24(45-16(3)36)28(31)46-17(4)37)23(39)26(40)32(6)19(18-9-10-43-13-18)11-22-35(32,33)48-22/h9-10,13,15,19-22,24-28,30,38,40-41H,8,11-12,14H2,1-7H3/t15u,19-,20u,21+,22+,24+,25u,26-,27-,28+,30?,31-,32+,33+,34+,35+/m0/s1

InChIKey: InChIKey=AYBKFVIPPCLFDH-QJWOUNLQBE
SMILES: CCC(C)C(=O)OC1C2(C3CC(C4(C(C3(CO1)C(C(C2OC(=O)C)OC(=O)C)O)C(=O)C(C5(C46C(O6)CC5C7=COC=C7)C)O)C)O)C

Names:
    APHANASTATIN
    NSC298100
    66700-76-3

Registries:
    PubChem CID 5458627
    PubChem ID 8140997