Ethyl [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-3-Yl] Phosphate
[CAS# 35002-96-1]

Identification

• Name: Ethyl [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-3-Yl] Phosphate
• Synonyms: Ethyl [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-3-Yl] Phosphate; Phosphoric Acid Ethyl [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methyl [(2R,3S,5R)-2-(Hydroxymethyl)-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-3-Tetrahydrofuranyl] Ester; Phosphoric Acid [(2R,3S,5R)-5-(2,4-Diketo-5-Methyl-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] Ethyl Ester
• Molecular Formula: C₂₂H₃₁N₄O₁₂P
• Molecular Weight: 574.48
• CAS Registry Number: 35002-96-1
• SMILES: [C@H]3(O[C@@H]([C@@H](O[P](OC[C@H]2O[C@@H](N1C(=O)NC(=O)C(=C1)C)C[C@@H]2O)(OCC)=O)C3)CO)N4C(=O)NC(=O)C(=C4)C
• InChI: 1S/C22H31N4O12P/c1-4-34-39(33,35-10-16-13(28)5-17(37-16)25-7-11(2)19(29)23-21(25)31)38-14-6-18(36-15(14)9-27)26-8-12(3)20(30)24-22(26)32/h7-8,13-18,27-28H,4-6,9-10H2,1-3H3,(H,23,29,31)(H,24,30,32)/t13-,14-,15+,16+,17+,18+,39?/m0/s1
• InChIKey: ZKKPILTYCWGWSA-KJOYEBRGSA-N

Properties

• Density: 1.554g/cm³ (Cal.)