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Abacavir-[d4]

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General Information
Catalog: BLP-011757
CAS: 1260619-56-4
Molecular Formula: C14H14D4N6O
Molecular Weight: 290.36

Chemical Structure

Description	Abacavir-[d4] is the labelled analogue of Abacavir, which is a nucleoside reverse transcriptase inhibitor.
Synonyms	Abacavir-d4; (1S,4R)-4-[2-Amino-6-(cyclopropylamino-d4)-9H-purin-9-yl]-2-cyclopentene-1-methanol; (1S-cis)-4-[2-Amino-6-(cyclopropylamino-d4)-9H-purin-9-yl]-2-cyclopentene-1-methanol; ABC-d4; Ziagen-d4
IUPAC Name	[(1S,4R)-4-[2-amino-6-[(2,2,3,3-tetradeuteriocyclopropyl)amino]purin-9-yl]cyclopent-2-en-1-yl]methanol
Related CAS	136470-78-5 (unlabelled) 1217731-56-0 (rel-(1R,4S))
Canonical SMILES	C1CC1NC2=C3C(=NC(=N2)N)N(C=N3)C4CC(C=C4)CO
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
InChI Key	MCGSCOLBFJQGHM-ZOTQTBSBSA-N
Melting Point	84-98 °C
Purity	97%; ≥95% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	Off-White to Light Beige Solid
Storage	Store at -20°C under inert atmosphere