[Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]Phosphoryl] [(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyloxan-2-Yl] Hydrogen Phosphate
[CAS# 130832-66-5]

Identification

• Name: [Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]Phosphoryl] [(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyloxan-2-Yl] Hydrogen Phosphate
• Synonyms: [Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy]Phosphoryl] [(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl] Hydrogen Phosphate; [Hydroxy-[[(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methoxy]Phosphoryl] [(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyl-2-Tetrahydropyranyl] Hydrogen Phosphate; [[(2R,3S,5R)-5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] [(4S,5S,6S)-5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl] Hydrogen Phosphate
• Molecular Formula: C₁₇H₂₈N₂O₁₄P₂
• Molecular Weight: 546.36
• CAS Registry Number: 130832-66-5
• SMILES: [C@@H]2(O)[C@H](O[C@@H](N1C=C(C(=O)NC1=O)C)C2)CO[P](O[P](OC3O[C@H]([C@H](O)[C@@H](OC)C3)C)(O)=O)(O)=O
• InChI: 1S/C17H28N2O14P2/c1-8-6-19(17(23)18-16(8)22)13-4-10(20)12(31-13)7-29-34(24,25)33-35(26,27)32-14-5-11(28-3)15(21)9(2)30-14/h6,9-15,20-21H,4-5,7H2,1-3H3,(H,24,25)(H,26,27)(H,18,22,23)/t9-,10-,11-,12+,13+,14?,15-/m0/s1
• InChIKey: KXTSABXLDGUXAE-MSIOBIFJSA-N

Properties

• Density: 1.636g/cm³ (Cal.)