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Salicylic Acid beta-D-O-Glucuronide

Product Code

TRC-S088130

CAS Number

7695-70-7

Product Format

Neat

Molecular Formula

C13 H14 O9

Molecular Weight

314.24

API Family

Aspirin

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials

Product Type

Metabolite

Price and availability

48-hour USA dispatch time
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Product Information

Chemical Data

Analyte Name

Salicylic Acid beta-D-O-Glucuronide

CAS Number

7695-70-7

Molecular Formula

C13 H14 O9

Molecular Weight

314.24

Accurate Mass

314.0638

SMILES

O[C@@H]1[C@@H](O)[C@H](Oc2ccccc2C(=O)O)O[C@@H]([C@H]1O)C(=O)O

InChI

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

IUPAC

(2S,3S,4S,5R,6S)-6-(2-carboxyphenoxy)-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

Aspirin

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