Analyte Name

Lorazepam 2-O-beta-D-Glucuronide-D4, 13C2

Molecular Formula

13C2 C19 D4 H14 Cl2 N2 O8

Molecular Weight

503.292

Accurate Mass

502.076

SMILES

[2H]c1c([2H])c([2H])c(C2=N[13CH](O)[13C](=Nc3ccc(Cl)cc23)O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)c(Cl)c1[2H]

InChI

InChI=1S/C21H18Cl2N2O8/c22-8-5-6-12-10(7-8)13(9-3-1-2-4-11(9)23)25-18(29)19(24-12)33-21-16(28)14(26)15(27)17(32-21)20(30)31/h1-7,14-18,21,26-29H,(H,30,31)/t14-,15-,16+,17-,18?,21-/m0/s1/i1D,2D,3D,4D,18+1,19+1

IUPAC

(2S,3S,4S,5R,6S)-6-[[7-chloro-5-(2-chloro-3,4,5,6-tetradeuteriophenyl)-3-hydroxy-3H-1,4-benzodiazepin-2-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

SIL Type

Deuterium, Carbon

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat