4-Amino-8-(ribofuranosylamino)pyrimido(5,4-d)pyrimidine-5'-phosphate
[CAS# 116168-71-9]

Identification

• Name: 4-Amino-8-(ribofuranosylamino)pyrimido(5,4-d)pyrimidine-5'-phosphate
• Synonyms: [(2R,3S,4R,5R)-5-[(4-Aminopyrimido[6,5-E]Pyrimidin-8-Yl)Amino]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-5-[(4-Amino-8-Pyrimido[6,5-E]Pyrimidinyl)Amino]-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-5-[(4-Aminopyrimido[6,5-E]Pyrimidin-8-Yl)Amino]-3,4-Dihydroxy-Oxolan-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₁H₁₅N₆O₇P
• Molecular Weight: 374.25
• CAS Registry Number: 116168-71-9
• SMILES: [C@@H]3(NC1=NC=NC2=C1N=CN=C2N)O[C@H](CO[P](O)(O)=O)[C@H]([C@H]3O)O
• InChI: 1S/C11H15N6O7P/c12-9-5-6(14-2-15-9)10(16-3-13-5)17-11-8(19)7(18)4(24-11)1-23-25(20,21)22/h2-4,7-8,11,18-19H,1H2,(H2,12,14,15)(H,13,16,17)(H2,20,21,22)/t4-,7-,8-,11-/m1/s1
• InChIKey: MQPZPMKOLGVOHA-TZQXKBMNSA-N

Properties

• Density: 1.924g/cm³ (Cal.)
• Boiling point: 809.865°C at 760 mmHg (Cal.)
• Flash point: 443.591°C (Cal.)