Analyte Name

Pseudo Morphine-d6 (Morphine-d3 Impurity)

Molecular Formula

C34H30D6N2O6

Molecular Weight

574.7

Accurate Mass

574.295

SMILES

[2H]C([2H])([2H])N1CC[C@]23[C@H]4Oc5c(O)c(cc(C[C@@H]1[C@@H]2C=C[C@@H]4O)c35)c6cc7C[C@@H]8[C@@H]9C=C[C@H](O)[C@@H]%10Oc(c6O)c7[C@]9%10CCN8C([2H])([2H])[2H]

InChI

InChI=1S/C34H36N2O6/c1-35-9-7-33-19-3-5-23(37)31(33)41-29-25(33)15(13-21(19)35)11-17(27(29)39)18-12-16-14-22-20-4-6-24(38)32-34(20,8-10-36(22)2)26(16)30(42-32)28(18)40/h3-6,11-12,19-24,31-32,37-40H,7-10,13-14H2,1-2H3/t19-,20-,21+,22+,23-,24-,31-,32-,33-,34-/m0/s1/i1D3,2D3

IUPAC

(4R,4aR,7S,7aR,12bS)-10-[(4R,4aR,7S,7aR,12bS)-7,9-dihydroxy-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-10-yl]-3-(trideuteriomethyl)-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7,9-diol

Unlabelled CAS Number

125-24-6

SIL Type

Deuterium

Country of Origin

CANADA

Product Format

Neat