Emtricitabine S-Oxide (Mixture of Diastereomers)

CAS: 152128-77-3

Ref. TR-E525030

Product Information

• Name: Emtricitabine S-Oxide (Mixture of Diastereomers)
• Synonyms: 2(1H)-Pyrimidinone, 4-amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-3-oxido-1,3-oxathiolan-5-yl]-, 1,3-Oxathiolane, 2(1H)-pyrimidinone deriv., 4-Amino-5-fluoro-1-[(2R,5S)-2-(hydroxymethyl)-3-oxido-1,3-oxathiolan-5-yl]-2(1H)-pyrimidinone, 2(1H)-Pyrimidinone, 4-amino-5-fluoro-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-, S-oxide, [2R-(2α,5α)]-, 2(1H)-Pyrimidinone, 4-amino-5-fluoro-1-[2-(hydroxymethyl)-3-oxido-1,3-oxathiolan-5-yl]-
• Brand: TRC

Description

Applications A metabolite of (-)-Emtricitabine (E525000).
References Schinazi, R.F., et al.: Antimicrob. Ag. Chemother., 36, 2423 (1992); Shockeor, J.P., et al.: Xenobioica, 26, 189 (1996); Feng, J.Y., et al.: FASEB J., 13, 1511 (1999); Molina, J.-M., et al.: J. Infec. Dis., 182, 599 (2000);

Chemical properties

• Molecular weight: 263.25
• Formula: C₈H₁₀FN₃O₄S
• Color/Form: Neat
• InChI: InChI=1S/C8H10FN3O4S/c9-4-1-12(8(14)11-7(4)10)5-3-17(15)6(2-13)16-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6+,17?/m0/s1
• InChI key: InChIKey=DMOMZPWPIDCLMB-CRRVBNTOSA-N
• SMILES: Nc1nc(=O)n([C@@H]2C[S@](=O)[C@H](CO)O2)cc1F