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Product Overview

Product Code

TRC-E525063

Product Format

Neat

Molecular Formula

C28H40FN8O13PS •

Molecular Weight

851.62

Product Categories

TRC, Anti-Hepatitis agents, Anti-HIV agents, Antivirals and antiretrovirals, Pharmaceutical Toxicology Reference Materials , Pharmaceutical Toxicology Reference Materials

Product Type

Bioactive Small Molecule

Alternate CAS Number

1962114-98-2

Documentation

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Product Information

Chemical Data

Analyte Name

Emtricitabine Tenofovir Disoproxil Dihydrochloride

Molecular Formula

C28H40FN8O13PS •

Molecular Weight

851.62

Accurate Mass

814.2

SMILES

C[C@@H](OCP(OCOC(OC(C)C)=O)(OCOC(OC(C)C)=O)=O)CN1C2=NC=NC(NCNC3=NC(N([C@@H]4CS[C@H](CO)O4)C=C3F)=O)=C2N=C1

InChI

InChI=1S/C28H40FN8O13PS.2ClH/c1-16(2)48-27(40)43-13-46-51(42,47-14-44-28(41)49-17(3)4)15-45-18(5)6-36-12-34-22-24(32-11-33-25(22)36)31-10-30-23-19(29)7-37(26(39)35-23)20-9-52-21(8-38)50-20;;/h7,11-12,16-18,20-21,38H,6,8-10,13-15H2,1-5H3,(H,30,35,39)(H,31,32,33);2*1H/t18-,20+,21-;;/m1../s1

IUPAC

((((((R)-1-(6-((((5-fluoro-1-((2R,5S)-2-(hydroxymethyl)-1,3-oxathiolan-5-yl)-2-oxo-1,2-dihydropyrimidin-4-yl)amino)methyl)amino)-9H-purin-9-yl)propan-2-yl)oxy)methyl)phosphoryl)bis(oxy))bis(methylene) diisopropyl bis(carbonate) hydrogen chloride

Alternate CAS Number

1962114-98-2

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Emtricitabine Tenofovir Disoproxil Dihydrochloride (>90%)

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