[[[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl]Oxy-Hydroxyphosphoryl] (2R,3S,4S,5S)-5-Acetamido-3,4,6-Trihydroxyoxane-2-Carboxylate
[CAS# 125710-37-4]

Identification

• Name: [[[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methoxy-Hydroxyphosphoryl]Oxy-Hydroxyphosphoryl] (2R,3S,4S,5S)-5-Acetamido-3,4,6-Trihydroxyoxane-2-Carboxylate
• Synonyms: [[[(2R,3S,4R,5R)-5-(2,4-Dioxopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl] (2R,3S,4S,5S)-5-Acetamido-3,4,6-Trihydroxy-Tetrahydropyran-2-Carboxylate; (2R,3S,4S,5S)-5-Acetamido-3,4,6-Trihydroxy-2-Tetrahydropyrancarboxylic Acid [[[(2R,3S,4R,5R)-5-(2,4-Dioxo-1-Pyrimidinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methoxy-Hydroxyphosphoryl]Oxy-Hydroxyphosphoryl] Ester; (2R,3S,4S,5S)-5-Acetamido-3,4,6-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid [[[(2R,3S,4R,5R)-5-(2,4-Diketopyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl] Ester
• Molecular Formula: C₁₇H₂₅N₃O₁₈P₂
• Molecular Weight: 621.34
• CAS Registry Number: 125710-37-4
• SMILES: [C@H]1(C(O)O[C@H]([C@H]([C@H]1O)O)C(=O)O[P](=O)(O)O[P](O)(=O)OC[C@@H]2[C@@H](O)[C@@H](O)[C@@H](O2)N3C(=O)NC(=O)C=C3)NC(=O)C
• InChI: 1S/C17H25N3O18P2/c1-5(21)18-8-10(24)11(25)13(36-15(8)27)16(28)37-40(32,33)38-39(30,31)34-4-6-9(23)12(26)14(35-6)20-3-2-7(22)19-17(20)29/h2-3,6,8-15,23-27H,4H2,1H3,(H,18,21)(H,30,31)(H,32,33)(H,19,22,29)/t6-,8+,9-,10+,11+,12-,13-,14-,15?/m1/s1
• InChIKey: PPKWAUXLIQKSTC-GGTZVBJBSA-N