Emtricitabine Triphosphate Triethylammonium Salt

CAS: 145819-92-7

Ref. TR-E525075

Product Information

• Name: Emtricitabine Triphosphate Triethylammonium Salt
• Synonyms: Triphosphoric Acid P-[[(2R,5S)-5-(4-Amino-5-fluoro-2-oxo-1(2H)-pyrimidinyl)-1,3- oxathiolan-2-yl]methyl] Ester Triethylammonium Salt, Triphosphoric Acid (2R-cis)-P-[[5-(4-Amino-5- fluoro-2-oxo-1(2H)-pyrimidinyl)-1,3-oxathiolan-2-yl]methyl] Ester Triethylammonium Salt, Emtricitabine 5'-Triphosphate Triethylammonium Salt, (-)-FTC-Triphosphate, 5-Fluoro-1-(2-Hydroxymethyl)-1,3-Oxathiolane-5-Yl-Cytidine-5'-Triphosphate, [(2R,5S)-5-(4-amino-5-fluoro-2,6-dioxo-3H-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methyl-(hydroxy-phosphonooxy-phosphoryl)oxy-phosphinic acid
• CAS: 145819-92-7

Description

Stability Hygroscopic
Applications Emtricitabine Triphosphate Triethylammonium Salt is a metabolite of (-)-Emtricitabine (E525000).
References Barditch-Crovo, P., et al.: Antimicrob. Agents Chemother., 45, 2733 (2001); Ray, A., et al.: Antivir .Ther., 10, 451 (2005); Borroto-Esoda, K., et al.: Antivir. Ther., 11, 377 (2006)

• Brand: TRC

Chemical properties

• Molecular weight: 487.19101193
• Formula: C₈H₁₃FN₃O₁₂P₃S• 3(C₆H₁₅N)
• Color/Form: White to Dark Yellow Solid
• InChI: InChI=1S/C8H13FN3O12P3S.3C6H15N/c9-4-1-12(8(13)11-7(4)10)5-3-28-6(22-5)2-21-26(17,18)24-27(19,20)23-25(14,15)16;3*1-4-7(5-2)6-3/h1,5-6H,2-3H2,(H,17,18)(H,19,20)(H2,10,11,13)(H2,14,15,16);3*4-6H2,1-3H3/t5-,6?;;;/m0.../s1
• InChI key: InChIKey=IBPFNJRARBQTNT-BXLPKDCTSA-N
• SMILES: CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.Nc1nc(=O)n([C@@H]2CSC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)cc1F