[(2R,3S,5R)-5-[4-[2-[(4-Azido-2,3,5,6-Tetrafluorobenzoyl)Amino]Ethylamino]-2-Oxopyrimidin-1-Yl]-3-Hydroxyoxolan-2-Yl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate
[CAS# 145278-12-2]

Identification

• Name: [(2R,3S,5R)-5-[4-[2-[(4-Azido-2,3,5,6-Tetrafluorobenzoyl)Amino]Ethylamino]-2-Oxopyrimidin-1-Yl]-3-Hydroxyoxolan-2-Yl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate
• Synonyms: [(2R,3S,5R)-5-[4-[2-[(4-Azido-2,3,5,6-Tetrafluoro-Benzoyl)Amino]Ethylamino]-2-Oxo-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-5-[4-[2-[[(4-Azido-2,3,5,6-Tetrafluorophenyl)-Oxomethyl]Amino]Ethylamino]-2-Oxo-1-Pyrimidinyl]-3-Hydroxy-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-5-[4-[2-[(4-Azido-2,3,5,6-Tetrafluoro-Benzoyl)Amino]Ethylamino]-2-Keto-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₁₈H₂₀F₄N₇O₁₄P₃
• Molecular Weight: 727.31
• CAS Registry Number: 145278-12-2
• SMILES: [N+](=NC1=C(F)C(=C(C(=C1F)F)C(=O)NCCNC3=NC(=O)N([C@@H]2O[C@@H]([C@@H](O)C2)CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)C=C3)F)=[N-]
• InChI: 1S/C18H20F4N7O14P3/c19-12-11(13(20)15(22)16(14(12)21)27-28-23)17(31)25-3-2-24-9-1-4-29(18(32)26-9)10-5-7(30)8(41-10)6-40-45(36,37)43-46(38,39)42-44(33,34)35/h1,4,7-8,10,30H,2-3,5-6H2,(H,25,31)(H,36,37)(H,38,39)(H,24,26,32)(H2,33,34,35)/t7-,8+,10+/m0/s1
• InChIKey: PJVRYRLWHIOPMH-QXFUBDJGSA-N