Xanthosine-5'-Triphosphate
[CAS# 6253-56-1]

Identification

• Name: Xanthosine-5'-Triphosphate
• Synonyms: [(2R,3S,4R)-5-(2,6-Dioxo-3H-Purin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,4R)-5-(2,6-Dioxo-3H-Purin-9-Yl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,4R)-5-(2,6-Diketo-3H-Purin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₁₀H₁₅N₄O₁₅P₃
• Molecular Weight: 524.17
• CAS Registry Number: 6253-56-1
• SMILES: [N]1(C2=C(N=C1)C(NC(N2)=O)=O)C3[C@@H]([C@@H]([C@H](O3)CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)O)O
• InChI: 1S/C10H15N4O15P3/c15-5-3(1-26-31(22,23)29-32(24,25)28-30(19,20)21)27-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H2,12,13,17,18)/t3-,5-,6-,9?/m1/s1
• InChIKey: CAEFEWVYEZABLA-LZGMGDPASA-N

Properties

• Density: 2.757g/cm³ (Cal.)