2'-Deoxyinosine 5'-triphosphate
[CAS# 16595-02-1]

Identification

• Name: 2'-Deoxyinosine 5'-triphosphate
• Synonyms: [(2R,3S,5R)-3-Hydroxy-5-(6-Oxo-3H-Purin-9-Yl)Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-3-Hydroxy-5-(6-Oxo-3H-Purin-9-Yl)-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-3-Hydroxy-5-(6-Keto-3H-Purin-9-Yl)Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₁₀H₁₅N₄O₁₃P₃
• Molecular Weight: 492.17
• CAS Registry Number: 16595-02-1
• SMILES: [C@@H]3(O)[C@H](O[C@@H]([N]1C2=C(N=C1)C(=O)N=CN2)C3)CO[P](O[P](O[P](O)(O)=O)(O)=O)(O)=O
• InChI: 1S/C10H15N4O13P3/c15-5-1-7(14-4-13-8-9(14)11-3-12-10(8)16)25-6(5)2-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-7,15H,1-2H2,(H,20,21)(H,22,23)(H,11,12,16)(H2,17,18,19)/t5-,6+,7+/m0/s1
• InChIKey: UFJPAQSLHAGEBL-RRKCRQDMSA-N

Properties

• Density: 2.515g/cm³ (Cal.)
• Boiling point: 955.624°C at 760 mmHg (Cal.)
• Flash point: 531.742°C (Cal.)