Adenosine1-Oxide Phosphate (1:3)
[CAS# 17670-17-6]

Identification

• Name: Adenosine1-Oxide Phosphate (1:3)
• Synonyms: adenosine N(1)-oxide triphosphate
• Molecular Formula: C₁₀H₂₂N₅O₁₇P₃
• Molecular Weight: 577.23
• CAS Registry Number: 17670-17-6
• SMILES: OP(O)(=O)O.OP(O)(=O)O.OP(O)(=O)O.Nc2c3ncn([C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c3nc[n+]2[O-]
• InChI: 1S/C10H13N5O5.3H3O4P/c11-8-5-9(13-3-15(8)19)14(2-12-5)10-7(18)6(17)4(1-16)20-10;3*1-5(2,3)4/h2-4,6-7,10,16-18H,1,11H2;3*(H3,1,2,3,4)/t4-,6-,7-,10-;;;/m1.../s1
• InChIKey: QIZDEKHQTSJBNJ-MSQVLRTGSA-N

Properties

• Boiling point: 1370.5°C at 760 mmHg (Cal.)
• Flash point: 782.6°C (Cal.)
• Refractive index: (Cal.)