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Product Overview

Product Code

TRC-K200810

CAS Number

76690-94-3

Product Format

Neat

Molecular Formula

C22 H22 O9

Molecular Weight

430.40

API Family

Ketoprofen

Product Categories

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

Product Type

Impurity, Metabolite

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

rac Ketoprofen Acyl-beta-D-glucuronide

CAS Number

76690-94-3

Molecular Formula

C22 H22 O9

Molecular Weight

430.40

Accurate Mass

430.1264

SMILES

CC(C(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)c2cccc(c2)C(=O)c3ccccc3

InChI

InChI=1S/C22H22O9/c1-11(13-8-5-9-14(10-13)15(23)12-6-3-2-4-7-12)21(29)31-22-18(26)16(24)17(25)19(30-22)20(27)28/h2-11,16-19,22,24-26H,1H3,(H,27,28)/t11?,16-,17-,18+,19-,22-/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[2-(3-benzoylphenyl)propanoyloxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Ketoprofen

Purity

>95% (HPLC)

Product Description

A metabolite of Ketoprofen (K200800(P)), which is an anti-inflammatory; analgesic.

References: Skordi, E., et al.: Xenobiotica, 34, 1075 (2004); Ueno, K., et al.: J. Med. Chem., 19, 941 (1976); Liversidge, G.G., Anal. Profiles Drug Subs., 10, 443 (1981); Jamali, F., et al.: Clin. Pharmacokinet., 19, 197 (1990)

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Ketoprofen Acyl-beta-D-glucuronide (Mixture of Diastereomers)

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