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Product Overview

Product Code

TRC-S088140

CAS Number

1376574-47-8

Product Format

Neat

Molecular Formula

C13H12K2O9

Molecular Weight

390.43

Product Categories

Flavonoids, Pharmaceutical Toxicology Reference Materials , TRC, API Reference Standards & Research Materials

Product Type

API

Alternate CAS Number

Free Acid: 41304-02-3

Documentation

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Product Information

Chemical Data

Analyte Name

p-Salicylic Acid 4-Glucuronide Potassium Salt

CAS Number

1376574-47-8

Molecular Formula

C13H12K2O9

Molecular Weight

390.43

Accurate Mass

389.98

SMILES

O[C@H]1[C@H](O)[C@@H](O)[C@H](OC2=CC=C(C(O[K])=O)C=C2)O[C@@H]1C(O[K])=O

InChI

InChI=1S/C13H14O9.2K/c14-7-8(15)10(12(19)20)22-13(9(7)16)21-6-3-1-5(2-4-6)11(17)18;;/h1-4,7-10,13-16H,(H,17,18)(H,19,20);;/q;2*+1/p-2/t7-,8-,9+,10?,13+;;/m0../s1

IUPAC

potassium (2S,3S,4S,5R,6S)-6-(4-carboxylatophenoxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylate

Alternate CAS Number

Free Acid: 41304-02-3

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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