[[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl] Hexadecane-1-Sulfonate
[CAS# 134282-88-5]

Identification

• Name: [[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl] Hexadecane-1-Sulfonate
• Synonyms: [[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Hexadecane-1-Sulfonate; Hexadecane-1-Sulfonic Acid [[(2R,3S,4R,5R)-5-(2,4-Dioxo-1-Pyrimidinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methoxy-Hydroxyphosphoryl] Ester; Hexadecane-1-Sulfonic Acid [[(2R,3S,4R,5R)-5-(2,4-Diketopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl] Ester
• Molecular Formula: C₂₅H₄₅N₂O₁₁PS
• Molecular Weight: 612.67
• CAS Registry Number: 134282-88-5
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO[P](O[S](=O)(=O)CCCCCCCCCCCCCCCC)(=O)O)N2C(=O)NC(=O)C=C2
• InChI: 1S/C25H45N2O11PS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-40(34,35)38-39(32,33)36-19-20-22(29)23(30)24(37-20)27-17-16-21(28)26-25(27)31/h16-17,20,22-24,29-30H,2-15,18-19H2,1H3,(H,32,33)(H,26,28,31)/t20-,22-,23-,24-/m1/s1
• InChIKey: KGZKOMDEPPSYQI-MSNJVRRCSA-N

Properties

• Density: 1.31g/cm³ (Cal.)