Thebainehydroquinone dimer diAc

Molecular Formula: C54H54N2O12


InChI: InChI=1/C54H54N2O12/c1-23(57)65-29-15-11-27(59)37-39(29)53(63-7)43-41(51(37)33-21-25-9-13-31(61-5)45-35(25)49(51,47(53)67-45)17-19-55(33)3)42-44(43)54(64-8)40-30(66-24(2)58)16-12-28(60)38(40)52(42)34-22-26-10-14-32(62-6)46-36(26)50(52,48(54)68-46)18-20-56(34)4/h9-16,33-34,41-44,47-48,59-60H,17-22H2,1-8H3

InChIKey: InChIKey=YRZWUZGUOHNUHU-UHFFFAOYAL
SMILES: CC(=O)OC1=C2C(=C(C=C1)O)C34C5CC6=C7C3(CCN5C)C(C2(C8C4C9C8C1(C2C34C9(C(CC5=C3C(=C(C=C5)OC)O2)N(CC4)C)C2=C(C=CC(=C21)OC(=O)C)O)OC)OC)OC7=C(C=C6)OC

Names:
    NSC69899
    Thebainehydroquinone dimer diAc
    Thebainehydroquinone, dimer, diacetate (ester)

Registries:
    PubChem CID 250420
    PubChem ID 113491