Analyte Name

Dihydromorphine 6-O-beta-D-Glucuronide-D3

Molecular Formula

C23H26D3NO9

Molecular Weight

466.5

Accurate Mass

466.2

SMILES

OC1=C2O[C@H]3[C@@H](O[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)C(O)=O)CC[C@@]5([H])[C@H]6CC(C=C1)=C2[C@@]35CCN6C([2H])([2H])[2H]

InChI

InChI=1S/C23H29NO9/c1-24-7-6-23-10-3-5-13(31-22-17(28)15(26)16(27)19(33-22)21(29)30)20(23)32-18-12(25)4-2-9(14(18)23)8-11(10)24/h2,4,10-11,13,15-17,19-20,22,25-28H,3,5-8H2,1H3,(H,29,30)/t10-,11+,13-,15-,16-,17+,19-,20-,22+,23-/m0/s1/i1D3

IUPAC

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-(((4R,4aR,7S,7aR,12bS)-9-hydroxy-3-(methyl-d3)-2,3,4,4a,5,6,7,7a-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid

Unlabelled CAS Number

70001-26-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat