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Product Overview

Product Code

TRC-Z675010

CAS Number

75871-31-7

Product Format

Neat

Molecular Formula

C21H22ClNO9

Molecular Weight

467.85

API Family

Zomepirac

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Product Type

Impurity, Metabolite

Purity

>95% (HPLC)

Drug Type

NSAIDs

Documentation

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Product Information

Chemical Data

Analyte Name

Zomepirac Acyl-O-beta-D-glucuronide

CAS Number

75871-31-7

Molecular Formula

C21H22ClNO9

Molecular Weight

467.85

Accurate Mass

467.0983

SMILES

CC1=C(N(C(=C1)CC(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)C)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO9/c1-9-7-12(23(2)14(9)15(25)10-3-5-11(22)6-4-10)8-13(24)31-21-18(28)16(26)17(27)19(32-21)20(29)30/h3-7,16-19,21,26-28H,8H2,1-2H3,(H,29,30)/t16-,17-,18+,19-,21+/m0/s1

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Zomepirac

Purity

>95% (HPLC)

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