bis-Bruceantinyl maleate

Molecular Formula: C59H72O24


InChI: InChI=1/C59H72O24/c1-22(2)24(5)13-34(62)82-42-46-56-20-76-58(46,52(72)74-11)48(68)38(66)44(56)54(9)18-30(60)40(26(7)28(54)15-32(56)78-50(42)70)80-36(64)17-37(65)81-41-27(8)29-16-33-57-21-77-59(53(73)75-12,49(69)39(67)45(57)55(29,10)19-31(41)61)47(57)43(51(71)79-33)83-35(63)14-25(6)23(3)4/h13-14,22-23,28-29,32-33,38-39,42-49,66-69H,15-21H2,1-12H3/b24-13+,25-14+/t28-,29-,32+,33+,38+,39+,42+,43+,44+,45+,46+,47+,48-,49-,54-,55-,56+,57+,58u,59u/m0/s1

InChIKey: InChIKey=IOOOZGXJELPBQN-LNRGMFDYBC
SMILES: CC1=C(C(=O)CC2(C1CC3C45C2C(C(C(C4C(C(=O)O3)OC(=O)C=C(C)C(C)C)(OC5)C(=O)OC)O)O)C)OC(=O)CC(=O)OC6=C(C7CC8C91COC(C9C(C(=O)O8)OC(=O)C=C(C)C(C)C)(C(C(C1C7(CC6=O)C)O)O)C(=O)OC)C

Names:
    bis-Bruceantinyl maleate
    NSC329089

Registries:
    PubChem CID 5384400
    PubChem ID 8141230