2'-Deoxytubercidin-5'-Triphosphate
[CAS# 67460-15-5]

Identification

• Name: 2'-Deoxytubercidin-5'-Triphosphate
• Synonyms: [(2R,3S,5R)-5-(4-Aminopyrrolo[2,3-D]Pyrimidin-7-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-5-(4-Amino-7-Pyrrolo[2,3-D]Pyrimidinyl)-3-Hydroxy-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,5R)-5-(4-Aminopyrrolo[2,3-D]Pyrimidin-7-Yl)-3-Hydroxy-Oxolan-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₁₁H₁₇N₄O₁₂P₃
• Molecular Weight: 490.20
• CAS Registry Number: 67460-15-5
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)[N]2C3=C(C=C2)C(=NC=N3)N
• InChI: 1S/C11H17N4O12P3/c12-10-6-1-2-15(11(6)14-5-13-10)9-3-7(16)8(25-9)4-24-29(20,21)27-30(22,23)26-28(17,18)19/h1-2,5,7-9,16H,3-4H2,(H,20,21)(H,22,23)(H2,12,13,14)(H2,17,18,19)/t7-,8+,9+/m0/s1
• InChIKey: AZJLCKAEZFNJDI-DJLDLDEBSA-N

Properties

• Desity: 2.373g/cm³ (Cal.)
• Boiling point: 891.842°C at 760 mmHg (Cal.)
• Flash point: 493.168°C (Cal.)