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Product Overview

Product Code

TRC-R100026

Product Format

Neat

Molecular Formula

C34H34LiNO10S

Molecular Weight

655.64

Product Categories

TRC, Additional endogenous metabolites, Pharmaceutical Toxicology Reference Materials

Product Type

Metabolite

Alternate CAS Number

Free acid: 174264-50-7

Documentation

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Product Information

Chemical Data

Analyte Name

Raloxifene 6-beta-D-Glucuronide Lithium Salt

Molecular Formula

C34H34LiNO10S

Molecular Weight

655.64

SMILES

OC(C=C1)=CC=C1C(S2)=C(C(C3=CC=C(OCCN4CCCCC4)C=C3)=O)C5=C2C=C(O[C@@H]6O[C@H](C(O[Li])=O)[C@@H](O)[C@H](O)[C@H]6O)C=C5

InChI

InChI=1S/C34H35NO10S.Li/c36-21-8-4-20(5-9-21)32-26(27(37)19-6-10-22(11-7-19)43-17-16-35-14-2-1-3-15-35)24-13-12-23(18-25(24)46-32)44-34-30(40)28(38)29(39)31(45-34)33(41)42;/h4-13,18,28-31,34,36,38-40H,1-3,14-17H2,(H,41,42);/q;+1/p-1/t28-,29-,30+,31-,34+;/m0./s1

Alternate CAS Number

Free acid: 174264-50-7

Product Data

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

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Raloxifene 6-Beta-D-Glucuronide Lithium Salt

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