3-O-(Codein-2-yl)morphine (1.0mg/ml in Methanol)

Analyte Name

3-O-(Codein-2-yl)morphine

Molecular Formula

C35H38N2O6

Molecular Weight

582.69

Measured Value

1.0 mg/mL

Accurate Mass

582.27

SMILES

[H][C@]1([C@H]2C3)[C@@]4(CCN2C)C5=C3C=C(OC6=C7C([C@]([C@@H](O7)[C@@H](O)C=C8)(CCN9C)[C@]8([H])[C@H]9C%10)=C%10C=C6)C(OC)=C5O[C@H]4[C@@H](O)C=C1

InChI

InChI=1S/C35H38N2O6/c1-36-12-10-34-19-5-7-23(38)32(34)42-29-25(9-4-17(27(29)34)14-21(19)36)41-26-16-18-15-22-20-6-8-24(39)33-35(20,11-13-37(22)2)28(18)31(43-33)30(26)40-3/h4-9,16,19-24,32-33,38-39H,10-15H2,1-3H3/t19-,20-,21+,22+,23-,24-,32-,33-,34-,35-/m0/s1

IUPAC

(4R,4aR,7S,7aR,12bS)-10-(((4R,4aR,7S,7aR,12bS)-7-hydroxy-3-methyl-2,3,4,4a,7,7a-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl)oxy)-9-methoxy-3-methyl-2,3,4,4a,7,7a-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Methanol