Temazepam Beta-D-Glucuronide, Mixture of Diastereomers (1.0 mg/ml in Methanol)

Analyte Name

Temazepam beta-D-Glucuronide

CAS Number

3703-53-5

Molecular Formula

C22 H21 Cl N2 O8

Molecular Weight

476.86

Measured Value

1.0 mg/mL

Accurate Mass

476.0986

SMILES

CN1C(=O)C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)N=C(c3ccccc3)c4cc(Cl)ccc14

InChI

InChI=1S/C22H21ClN2O8/c1-25-13-8-7-11(23)9-12(13)14(10-5-3-2-4-6-10)24-19(20(25)29)33-22-17(28)15(26)16(27)18(32-22)21(30)31/h2-9,15-19,22,26-28H,1H3,(H,30,31)/t15-,16-,17+,18-,19?,22-/m0/s1

IUPAC

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

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Single Solution

Matrix

Methanol