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2-O-tert-Butyldimethylsilyl (-)-Emtricitabine-[13C,15N2]

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General Information
Catalog: BLP-006156
CAS: 1246816-05-6
Molecular Formula: C13[13C]H24FN[15N]2O3SSi
Molecular Weight: 364.49

Chemical Structure

Description	2-O-tert-Butyldimethylsilyl (-)-Emtricitabine-[13C,15N2] is the labelled analogue of 2-O-tert-Butyldimethylsilyl (-)-Emtricitabine, which is a derivative of Emtricitabine.
Synonyms	4-Amino-1-((2R,5S)-2-((tert-butyldimethylsilyloxy)methyl)-1,3-oxathiolan-5-yl)-5-fluoropyrimidin-2(1H)-one-13C,15N2; 2-O-tert-Butyldimethylsilyl (-)-Emtricitabine-13C,15N2; (-)-5'-O-(t-butyldimethylsilyl)-5-fluoro-2',3'-dideoxy-3'-thiacytidine-13C,15N2
IUPAC Name	4-amino-1-[(2R,5S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-1,3-oxathiolan-5-yl]-5-fluoro(2-13C,1,3-15N2)pyrimidin-2-one
Related CAS	1365246-84-9 (unlabelled)
Canonical SMILES	CC(C)(C)[Si](C)(C)OCC1OC(CS1)N2C=C(C(=NC2=O)N)F
InChI	InChI=1S/C14H24FN3O3SSi/c1-14(2,3)23(4,5)20-7-11-21-10(8-22-11)18-6-9(15)12(16)17-13(18)19/h6,10-11H,7-8H2,1-5H3,(H2,16,17,19)/t10-,11+/m0/s1/i13+1,17+1,18+1
InChI Key	PZAVJQRKDBGTSP-RHHHEITCSA-N
Purity	>90%
Solubility	Soluble in Methanol
Appearance	Yellow Solid
Storage	Store at 2-8°C