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Emtricitabine Carboxylic Acid-[13C,15N2]

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General Information
Catalog: BLP-005296
Molecular Formula: C7[13C]H8FN[15N]2O4S
Molecular Weight: 264.21

Chemical Structure

Description	Emtricitabine Carboxylic Acid-[13C,15N2], is the labelled analogue of Emtricitabine Carboxylic Acid, which is an impurity of the antiviral agent Emtricitabine. Emtricitabine is a nucleoside reverse-transcriptase inhibitor for the prevention and treatment of HIV infection in adults and children.
Synonyms	Emtricitabine Carboxylic Acid-13C 15N2
IUPAC Name	(2R,5S)-5-(4-amino-5-fluoro-2-oxopyrimidin-1(2H)-yl-2-13C-1,3-15N2)-1,3-oxathiolane-2-carboxylic acid
Related CAS	1238210-10-0 (unlabelled)
Canonical SMILES	C1C(OC(S1)C(=O)O)N2C=C(C(=NC2=O)N)F
InChI	InChI=1S/C8H8FN3O4S/c9-3-1-12(8(15)11-5(3)10)4-2-17-7(16-4)6(13)14/h1,4,7H,2H2,(H,13,14)(H2,10,11,15)/t4-,7+/m0/s1/i8+1,11+1,12+1
InChI Key	GQHACZWRCOKKIZ-DMQCAZCQSA-N
Solubility	Soluble in DMSO, Methanol
Appearance	White to Pale Yellow Solid
Storage	Store at -20°C, Under inert atmosphere