Product Code

TRC-F598715

CAS Number

91683-37-3

Product Format

Neat

Molecular Formula

C21 H21 F O8

Molecular Weight

420.38

API Family

Flurbiprofen

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials

Product Type

Metabolite, API

Drug Type

NSAIDs

Price and availability

48-hour USA dispatch time

Freight restricted.

If Exact Weight packaging is selected, a certificate will be delivered with the product, which will indicate the mass of the material dispensed into the vial with a precision of up to 3 decimal places. Exceptions apply.

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Product Information

Chemical Data

Analyte Name

Flurbiprofen acyl-beta-D-Glucuronide (mixture of diastereomers)

CAS Number

91683-37-3

Molecular Formula

C21 H21 F O8

Molecular Weight

420.38

Accurate Mass

420.122

SMILES

CC(C(=O)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)c2ccc(c(F)c2)c3ccccc3

InChI

InChI=1S/C21H21FO8/c1-10(12-7-8-13(14(22)9-12)11-5-3-2-4-6-11)20(28)30-21-17(25)15(23)16(24)18(29-21)19(26)27/h2-10,15-18,21,23-25H,1H3,(H,26,27)/t10?,15-,16-,17+,18-,21-/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[2-(3-fluoro-4-phenyl-phenyl)propanoyloxy]-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Metabolite

Product Format

Neat

API Family

Flurbiprofen

Product Description

Metabolite of Flurbiprofen (F598700).

References: Van Breemen, R., et al.: Drug Metab. Disposition, 14, 197 (1986), Spraul, M., et al.: J. Pharm. Biomed. Anal., 11, 1009 (1993),

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Flurbiprofen Acyl-Beta-D-glucuronide (Mixture of Diastereomers)

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