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Product Overview

Product Code

TRC-D296750

CAS Number

77326-93-3

Product Format

Neat

Molecular Formula

C26 H36 N2 O4

Molecular Weight

440.58

Product Categories

TRC, Amphetamine Reference Materials , NMR solvents, NMR solvents & reagents, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Metabolite, API

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Product Information

Chemical Data

Analyte Name

p-O-Desmethyl Verapamil

CAS Number

77326-93-3

Molecular Formula

C26 H36 N2 O4

Molecular Weight

440.58

Accurate Mass

440.2675

SMILES

COc1ccc(cc1OC)C(CCCN(C)CCc2ccc(O)c(OC)c2)(C#N)C(C)C

InChI

InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-11-23(30-4)25(17-21)32-6)13-7-14-28(3)15-12-20-8-10-22(29)24(16-20)31-5/h8-11,16-17,19,29H,7,12-15H2,1-6H3

IUPAC

2-(3,4-dimethoxyphenyl)-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl-methylamino]-2-propan-2-ylpentanenitrile

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

Product Description

Verapamil metabolite.

References: Nelson, W.L., et al.: Drug Metab. Dispos., 16, 184 (1988)

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