[(2R,3S,5R)-5-(4-Amino-2-Oxopyrimidin-1-Yl)-3-Hydroxyoxolan-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-3-Yl] Hydrogen Phosphate
[CAS# 5178-19-8]

Identification

• Name: [(2R,3S,5R)-5-(4-Amino-2-Oxopyrimidin-1-Yl)-3-Hydroxyoxolan-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-3-Yl] Hydrogen Phosphate
• Synonyms: [(2R,3S,5R)-5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-3-Yl] Hydrogen Phosphate; [(2R,3S,5R)-5-(4-Amino-2-Oxo-1-Pyrimidinyl)-3-Hydroxy-2-Tetrahydrofuranyl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-3-Tetrahydrofuranyl] Hydrogen Phosphate; [(2R,3S,5R)-5-(4-Amino-2-Keto-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl [(2R,3S,5R)-5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)-2-Methylol-Tetrahydrofuran-3-Yl] Hydrogen Phosphate
• Molecular Formula: C₁₉H₂₆N₅O₁₁P
• Molecular Weight: 531.42
• CAS Registry Number: 5178-19-8
• SMILES: [C@H]3(O[C@@H]([C@@H](O[P](OC[C@H]2O[C@@H](N1C(=O)N=C(N)C=C1)C[C@@H]2O)(=O)O)C3)CO)N4C(=O)NC(=O)C(=C4)C
• InChI: 1S/C19H26N5O11P/c1-9-6-24(19(29)22-17(9)27)16-5-11(12(7-25)33-16)35-36(30,31)32-8-13-10(26)4-15(34-13)23-3-2-14(20)21-18(23)28/h2-3,6,10-13,15-16,25-26H,4-5,7-8H2,1H3,(H,30,31)(H2,20,21,28)(H,22,27,29)/t10-,11-,12+,13+,15+,16+/m0/s1
• InChIKey: JOORWUINAFDIEP-SWTKMSQOSA-N

Properties

• Density: 1.91g/cm³ (Cal.)