Analyte Name

N-[6-Deoxycodeine-6beta-yl]-5-maleimidopentanamide

Molecular Formula

C27H31N3O5

Molecular Weight

477.56

Accurate Mass

477.23

SMILES

COC1=C2O[C@@H]3[C@]45C2=C(C=C1)C[C@@H](N(CC5)C)[C@]4([H])C=C[C@H]3NC(CCCCN6C(C=CC6=O)=O)=O

InChI

InChI=1S/C27H31N3O5/c1-29-14-12-27-17-7-8-18(28-21(31)5-3-4-13-30-22(32)10-11-23(30)33)26(27)35-25-20(34-2)9-6-16(24(25)27)15-19(17)29/h6-11,17-19,26H,3-5,12-15H2,1-2H3,(H,28,31)/t17-,18+,19+,26-,27-/m0/s1

IUPAC

5-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)-N-((4R,4aR,7R,7aR,12bS)-9-methoxy-3-methyl-2,3,4,4a,7,7a-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl)pentanamide

Country of Origin

CANADA

Product Format

Neat