Tubercidin 5'-phosphate
[CAS# 16719-46-3]

Identification

• Name: Tubercidin 5'-phosphate
• Synonyms: [(2R,3S,4R,5R)-5-(4-Aminopyrrolo[3,2-E]Pyrimidin-7-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-5-(4-Amino-7-Pyrrolo[3,2-E]Pyrimidinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-5-(4-Aminopyrrolo[3,2-E]Pyrimidin-7-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₁H₁₅N₄O₇P
• Molecular Weight: 346.24
• CAS Registry Number: 16719-46-3 (28302-62-7)
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO[P](=O)(O)O)[N]2C3=C(C=C2)C(=NC=N3)N
• InChI: 1S/C11H15N4O7P/c12-9-5-1-2-15(10(5)14-4-13-9)11-8(17)7(16)6(22-11)3-21-23(18,19)20/h1-2,4,6-8,11,16-17H,3H2,(H2,12,13,14)(H2,18,19,20)/t6-,7-,8-,11-/m1/s1
• InChIKey: OBKZXEICLJXEAO-KCGFPETGSA-N

Properties

• Density: 2.15g/cm³ (Cal.)
• Boiling point: 772.023°C at 760 mmHg (Cal.)
• Flash point: 420.704°C (Cal.)