Product Code

TRC-M831520

CAS Number

31528-44-6

Product Format

Neat

Molecular Formula

C23 H28 O12

Molecular Weight

496.46

API Family

Mycophenolic Sodium, Mycophenolate Mofetil

Product Categories

TRC, Additional endogenous metabolites, Cancer Research Chemicals and Analytical Standards, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Product Type

Impurity, Metabolite

Alternate CAS Number

27107-52-4

Purity

>95% (HPLC)

Drug Type

Immunosuppressants

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Mycophenolic acid-beta-D-glucuronide

CAS Number

31528-44-6

Molecular Formula

C23 H28 O12

Molecular Weight

496.46

Accurate Mass

496.1581

SMILES

COc1c(C)c2COC(=O)c2c(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)c1C\C=C(/C)\CCC(=O)O

InChI

InChI=1S/C23H28O12/c1-9(5-7-13(24)25)4-6-11-18(32-3)10(2)12-8-33-22(31)14(12)19(11)34-23-17(28)15(26)16(27)20(35-23)21(29)30/h4,15-17,20,23,26-28H,5-8H2,1-3H3,(H,24,25)(H,29,30)/b9-4+/t15-,16-,17+,20-,23+/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[[5-[(E)-5-carboxy-3-methylpent-2-enyl]-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-4-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Alternate CAS Number

27107-52-4

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Mycophenolic Sodium; Mycophenolate Mofetil

Purity

>95% (HPLC)

Product Description

A metabolite of Mycophenolic Acid (M831500), an antibiotic produced by Penicillium brevi-compactum, P. Stoloniferum and related spp. A selective inhibitor of lymphocyte proliferation by blocking inosine monophosphate dehydrogenase, an enzyme involved in the de novo synthesis of purine nucleotides.

References: Senda, M., et al.: Transplantation, 60, 1143 (1995), Nimmesgern, E., et al.: J. Biol. Chem., 271, 19421 (1996), Gummert, J.F., et al.: J. Pharmacol. Exp. Ther., 291, 1100 (1999),

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Mycophenolic Acid Beta-D-Glucuronide

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