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Product Overview

Product Code

TRC-A105002

CAS Number

1217731-56-0

Product Format

Neat

Molecular Formula

C14H14D4N6O

Molecular Weight

290.36

API Family

Abacavir

Product Categories

TRC, API Reference Standards & Research Materials, Stable Isotope Labelled Analytical Standards, Stable isotopes, Pharmaceutical Toxicology Reference Materials , Pharmaceutical Toxicology Reference Materials , Nucleotides & nucleosides

Product Type

Stable Isotope Labelled, Metabolite, API

Unlabelled CAS Number

136470-78-5

Drug Type

Antivirals

Documentation

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Product Information

Chemical Data

Analyte Name

Abacavir-d4

CAS Number

1217731-56-0

Molecular Formula

C14H14D4N6O

Molecular Weight

290.36

SMILES

NC1=NC2=C(N=CN2[C@H]3C=C[C@@H](CO)C3)C(NC4C([2H])([2H])C4([2H])[2H])=N1

InChI

InChI=1S/C14H18N6O/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19)/t8-,10+/m1/s1/i2D2,3D2

IUPAC

[(1S,4R)-4-[2-amino-6-[(2,2,3,3-tetradeuteriocyclopropyl)amino]purin-9-yl]cyclopent-2-en-1-yl]methanol

Unlabelled CAS Number

136470-78-5

SIL Type

Deuterium

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Stable Isotope Labelled; Metabolite; API

Product Format

Neat

API Family

Abacavir

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