[(2R,3S,5S)-5-(5-Azido-2,4-Dioxopyrimidin-1-Yl)-3-Hydroxyoxolan-2-Yl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate
[CAS# 105449-09-0]

Identification

• Name: [(2R,3S,5S)-5-(5-Azido-2,4-Dioxopyrimidin-1-Yl)-3-Hydroxyoxolan-2-Yl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate
• Synonyms: [(2R,3S,5S)-5-(5-Azido-2,4-Dioxo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,5S)-5-(5-Azido-2,4-Dioxo-1-Pyrimidinyl)-3-Hydroxy-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,5S)-5-(5-Azido-2,4-Diketo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₉H₁₄N₅O₁₄P₃
• Molecular Weight: 509.16
• CAS Registry Number: 105449-09-0
• SMILES: [N+](=NC2=CN([C@H]1O[C@@H]([C@@H](O)C1)CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)C(=O)NC2=O)=[N-]
• InChI: 1S/C9H14N5O14P3/c10-13-12-4-2-14(9(17)11-8(4)16)7-1-5(15)6(26-7)3-25-30(21,22)28-31(23,24)27-29(18,19)20/h2,5-7,15H,1,3H2,(H,21,22)(H,23,24)(H,11,16,17)(H2,18,19,20)/t5-,6+,7-/m0/s1
• InChIKey: YTBBHULLYXWWIB-XVMARJQXSA-N