[[5-(2,4-Dioxopyrimidin-1-Yl)-3-Hydroxy-Oxolan-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxyphosphonic Acid
[CAS# 4208-67-7]

Identification

• Name: [[5-(2,4-Dioxopyrimidin-1-Yl)-3-Hydroxy-Oxolan-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxyphosphonic Acid
• Synonyms: [(2R,3S,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate; [(2R,3S,5R)-5-(2,4-Dioxo-1-Pyrimidinyl)-3-Hydroxy-2-Tetrahydrofuranyl]Methyl Phosphono Hydrogen Phosphate; [(2R,3S,5R)-5-(2,4-Diketopyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Phosphono Hydrogen Phosphate
• Molecular Formula: C₉H₁₄N₂O₁₁P₂
• Molecular Weight: 388.16
• CAS Registry Number: 4208-67-7
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO[P](O[P](=O)(O)O)(=O)O)N2C(=O)NC(=O)C=C2
• InChI: 1S/C9H14N2O11P2/c12-5-3-8(11-2-1-7(13)10-9(11)14)21-6(5)4-20-24(18,19)22-23(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,18,19)(H,10,13,14)(H2,15,16,17)/t5-,6+,8+/m0/s1
• InChIKey: QHWZTVCCBMIIKE-SHYZEUOFSA-N

Properties

• Density: 1.895g/cm³ (Cal.)