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Product Overview

Product Code

TRC-D452802

CAS Number

1189859-26-4

Product Format

Neat

Molecular Formula

C14H5D4ClF3NO4

Molecular Weight

351.70

API Family

Efavirenz

Product Categories

TRC, Stable Isotope Labelled Analytical Standards, Antivirals and antiretrovirals, Antivirals, Impurity Reference Materials , Antivirals and antiretrovirals, Stable isotopes, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

Stable Isotope Labelled, Metabolite, API, Synthesis tool

Unlabelled CAS Number

1189909-96-3

Documentation

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Product Information

Chemical Data

Analyte Name

rac 8,14-Dihydroxy Efavirenz-d4

CAS Number

1189859-26-4

Molecular Formula

C14H5D4ClF3NO4

Molecular Weight

351.70

SMILES

[2H]C1([2H])C([2H])([2H])C1(O)C#CC2(OC(=O)Nc3c(O)cc(Cl)cc23)C(F)(F)F

InChI

InChI=1S/C14H9ClF3NO4/c15-7-5-8-10(9(20)6-7)19-11(21)23-13(8,14(16,17)18)4-3-12(22)1-2-12/h5-6,20,22H,1-2H2,(H,19,21)/i1D2,2D2

Unlabelled CAS Number

1189909-96-3

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite; Stable Isotope Labelled

Product Format

Neat

API Family

Efavirenz

Product Description

A labelled metabolite of Efavirenz (E425000) (secondary metabolism).

References: Gorski, J., et al.: Biochem. Pharmacol., 47, 1643 (1994), Desta, Z., et al.: J. Pharmacol. Exp. Ther., 285, 428 (1998), Langmann, P., et al.: Eur. J. Med. Res., 7, 309 (2002), Chang, T., et al.: Drug Metab. Dispos., 31, 7 (2003),

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