Pholcodine Impurity D

Analyte Name

7,8-Didehydro-4,5Alpha-epoxy-17-methyl-3,6Alpha-bis[2-(morpholin-4-yl)ethoxy]morphinan

CAS Number

291532-18-8

Molecular Formula

C29 H41 N3 O5

Molecular Weight

511.653

Accurate Mass

511.305

SMILES

CN1CC[C@]23[C@H]4Oc5c(OCCN6CCOCC6)ccc(C[C@@H]1[C@@H]2C=C[C@@H]4OCCN7CCOCC7)c35

InChI

InChI=1S/C29H41N3O5/c1-30-7-6-29-22-3-5-25(36-19-13-32-10-16-34-17-11-32)28(29)37-27-24(4-2-21(26(27)29)20-23(22)30)35-18-12-31-8-14-33-15-9-31/h2-5,22-23,25,28H,6-20H2,1H3/t22-,23+,25-,28-,29-/m0/s1

IUPAC

(4R,4aR,7S,7aR,12bS)-3-methyl-7,9-bis(2-morpholin-4-ylethoxy)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat