Product Code

TRC-D292042

CAS Number

152764-52-8

Product Format

Neat

Molecular Formula

C31 H35 N O8

Molecular Weight

549.61

API Family

Tamoxifen

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials , Impurity Reference Materials

Product Type

Impurity, Metabolite, API

Alternate CAS Number

(Z)-isomer: 956414-04-3; (E)-isomer: 152764-52-8

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

N-Desmethyl-4-hydroxy Tamoxifen beta-D-Glucuronide (E,Z mixture)

CAS Number

152764-52-8

Molecular Formula

C31 H35 N O8

Molecular Weight

549.61

Accurate Mass

549.2363

SMILES

CCC(=C(c1ccc(OCCNC)cc1)c2ccc(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(=O)O)cc2)c4ccccc4

InChI

InChI=1S/C31H35NO8/c1-3-24(19-7-5-4-6-8-19)25(20-9-13-22(14-10-20)38-18-17-32-2)21-11-15-23(16-12-21)39-31-28(35)26(33)27(34)29(40-31)30(36)37/h4-16,26-29,31-35H,3,17-18H2,1-2H3,(H,36,37)/t26-,27-,28+,29-,31+/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[4-[1-[4-[2-(methylamino)ethoxy]phenyl]-2-phenyl-but-1-enyl]phenoxy]tetrahydropyran-2-carboxylic acid

Alternate CAS Number

(Z)-isomer: 956414-04-3; (E)-isomer: 152764-52-8

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Metabolite

Product Format

Neat

API Family

Tamoxifen

Product Description

A novel active metabolite of the anti-cancer drug Tamoxifen (T006000).

References: Furr, B., et al.: Pharmacol. Ther., 25, 127

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N-Desmethyl-4-hydroxy Tamoxifen Beta-D-Glucuronide (E/Z Mixture)

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