Emtricitabine 5-O-Sulfate-13C,15N2
Product Code
TRC-E525082-25MG
Product Format
Neat
Molecular Formula
13C C7 H10 F 15N2 N O6 S2
Molecular Weight
330.289
Product Categories
TRC, Stable isotopes, Pharmaceutical Toxicology Reference Materials
Product Type
Stable Isotope LabelledProduct Information
Chemical Data
Analyte Name
Emtricitabine 5-O-Sulfate-13C,15N2
Molecular Formula
13C C7 H10 F 15N2 N O6 S2
Molecular Weight
330.289
Accurate Mass
329.997
SMILES
NC1=[15N][13C](=O)[15N](C=C1F)[C@@H]2CS[C@H](COS(=O)(=O)O)O2
InChI
InChI=1S/C8H10FN3O6S2/c9-4-1-12(8(13)11-7(4)10)5-3-19-6(18-5)2-17-20(14,15)16/h1,5-6H,2-3H2,(H2,10,11,13)(H,14,15,16)/t5-,6+/m0/s1/i8+1,11+1,12+1
IUPAC
[(2R,5S)-5-(4-amino-5-fluoro-2-oxo(213C,1,3-15N2)pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl hydrogen sulfate
SIL Type
Carbon, Nitrogen
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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