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Product Overview

Product Code

TRC-G305775

Product Format

Neat

Molecular Formula

C28H38O12

Molecular Weight

566.59

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive Small Molecule

Documentation

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Product Information

Chemical Data

Analyte Name

Gemfibrozil 1-O-beta-D-(3,4,5-O-Triacetyl)glucuronide Methyl Ester

Molecular Formula

C28H38O12

Molecular Weight

566.59

Accurate Mass

566.24

SMILES

O=C(O[C@@H]1O[C@H](C(OC)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(C)(C)CCCOC2=C(C)C=CC(C)=C2

InChI

InChI=1S/C28H38O12/c1-15-10-11-16(2)20(14-15)35-13-9-12-28(6,7)27(33)40-26-24(38-19(5)31)22(37-18(4)30)21(36-17(3)29)23(39-26)25(32)34-8/h10-11,14,21-24,26H,9,12-13H2,1-8H3/t21-,22-,23-,24+,26-/m0/s1

IUPAC

(2S,3R,4S,5S,6S)-2-((5-(2,5-dimethylphenoxy)-2,2-dimethylpentanoyl)oxy)-6-(methoxycarbonyl)tetrahydro-2H-pyran-3,4,5-triyl triacetate

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Gemfibrozil 1-O-Beta-D-(3,4,5-O-Triacetyl)glucuronide Methyl Ester

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