Product Code

TRC-A555400

CAS Number

188717-04-6

Product Format

Neat

Molecular Formula

C9 H14 O7

Molecular Weight

234.20

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive Small Molecule

Price and availability

48-hour USA dispatch time

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Product Information

Chemical Data

Analyte Name

Allyl D-glucuronate

CAS Number

188717-04-6

Molecular Formula

C9 H14 O7

Molecular Weight

234.20

Accurate Mass

234.074

SMILES

OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)OCC=C

InChI

InChI=1S/C9H14O7/c1-2-3-15-9(14)7-5(11)4(10)6(12)8(13)16-7/h2,4-8,10-13H,1,3H2/t4-,5-,6+,7-,8?/m0/s1

IUPAC

prop-2-enyl (2S,3S,4S,5R)-3,4,5,6-tetrahydroxyoxane-2-carboxylate

Product Data

Storage Temperature

-86°C

Shipping Temperature

Blue Ice

Country of Origin

CANADA

Product Format

Neat

Product Description

It is used in efficient synthesis of 1b-O-acyl glucuronides via regioselective acylation of allyl or benzyl D-glucuronate.?cyl glucuronides are known metabolites of important drugs.

References: Kaspersen, F., et al.: Xenobiotica, 17, 1451

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