(-)-2,3-DEHYDROISOEMETINE, DIHYDROBROMIDE

Molecular Formula: C₂₉H₄₀Br₂N₂O₄

InChI: InChI=1/C29H38N2O4.2BrH/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24;;/h13-16,24-25,30H,6-12,17H2,1-5H3;2*1H/fC29H40N2O4.2Br/h30-31H;2*1h/q+2;2*-1

InChIKey: InChIKey=IRZYJLQDCUNDMY-IBRBGFQPCR
SMILES: CCC1=C(CC2C3=CC(=C(C=C3CC[NH+]2C1)OC)OC)CC4C5=CC(=C(C=C5CC[NH2+]4)OC)OC.[Br-].[Br-]

Names:
    (-)-2,3-DEHYDROISOEMETINE, DIHYDROBROMIDE
    2649-50-5

Registries:
    PubChem CID 17557
    PubChem ID 160709