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Product Overview

Product Code

TRC-T413050

CAS Number

7702-71-8

Product Format

Neat

Molecular Formula

C16H22O7

Molecular Weight

326.34

Product Categories

Antimicrobials, Building blocks, TRC

Documentation

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Product Information

Chemical Data

Analyte Name

Thymol O-b-D-Glucuronide

CAS Number

7702-71-8

Molecular Formula

C16H22O7

Molecular Weight

326.34

Accurate Mass

326.14

SMILES

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

InChI

InChI=1S/C16H22O7/c1-7(2)9-5-4-8(3)6-10(9)22-16-13(19)11(17)12(18)14(23-16)15(20)21/h4-7,11-14,16-19H,1-3H3,(H,20,21)/t11-,12-,13+,14-,16+/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(2-isopropyl-5-methylphenoxy)tetrahydro-2H-pyran-2-carboxylic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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