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Product Overview

Product Code

TRC-E582335

CAS Number

603133-91-1

Product Format

Neat

Molecular Formula

C21 H22 O12

Molecular Weight

466.392

Product Categories

TRC, API Reference Standards & Research Materials

Product Type

API

Purity

>95% (HPLC)

Documentation

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Product Information

Chemical Data

Analyte Name

(-)-Epicatechin-3'-O-glucuronide

CAS Number

603133-91-1

Molecular Formula

C21 H22 O12

Molecular Weight

466.392

Accurate Mass

466.111

SMILES

O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(=O)O)c3

InChI

InChI=1S/C21H22O12/c22-8-4-11(24)9-6-12(25)18(31-13(9)5-8)7-1-2-10(23)14(3-7)32-21-17(28)15(26)16(27)19(33-21)20(29)30/h1-5,12,15-19,21-28H,6H2,(H,29,30)/t12-,15+,16+,17-,18-,19+,21-/m1/s1

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-hydroxy-5-[(2R,3R)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl]phenoxy]oxane-2-carboxylic acid

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

Purity

>95% (HPLC)

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Chemical Data

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