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Product Overview

Product Code

TRC-A624010

Product Format

Neat

Molecular Formula

C12 H14 N Na O7

Molecular Weight

307.232

Product Categories

TRC, Carbohydrates

Product Type

Metabolite

Documentation

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Product Information

Chemical Data

Analyte Name

4-Aminophenyl b-D-Glucuronide Sodium Salt

Molecular Formula

C12 H14 N Na O7

Molecular Weight

307.232

Accurate Mass

307.067

SMILES

Nc1ccc(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O[Na])cc1

InChI

InChI=1S/C12H15NO7.Na/c13-5-1-3-6(4-2-5)19-12-9(16)7(14)8(15)10(20-12)11(17)18;/h1-4,7-10,12,14-16H,13H2,(H,17,18);/q;+1/p-1/t7-,8-,9+,10-,12+;/m0./s1

IUPAC

[(2S,3S,4S,5R,6S)-6-(4-aminophenoxy)-3,4,5-trihydroxyoxane-2-carbonyl]oxysodium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Product Description

Metabolite of p-Aminophenol

References: Yan, Z., et al.: Drug Metab. Disposition, 28, 880 (2000), Nohynek, G., et al.: Toxicol. Lett., 158, 196 (2005),

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4-Aminophenyl beta-D-Glucuronide Sodium Salt

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