(4aR,6R,7R,7aS)-6-[6-Amino(8-³H)-9H-Purin-9-Yl]Tetrahydro-4H-Furo[3,2-d][1,3,2]Dioxaphosphinine-2,7-Diol 2-Oxide
[CAS# 50816-76-7]

Identification

• Name: (4aR,6R,7R,7aS)-6-[6-Amino(8-³H)-9H-Purin-9-Yl]Tetrahydro-4H-Furo[3,2-d][1,3,2]Dioxaphosphinine-2,7-Diol 2-Oxide
• Synonyms: ADENOSINE-8(3)H3,5-CYCLICMONOPHOSPHATE; Adenosine-8-3H 3′,5′-cyclic monophosphate
• Molecular Formula: C₁₀H₁₁TN₅O₆P
• Molecular Weight: 331.21
• CAS Registry Number: 50816-76-7
• SMILES: [3H]c2nc1c(ncnc1n2[C@@H]3O[C@@H]4COP(=O)(O[C@H]4[C@H]3O)O)N
• InChI: 1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1/i3T
• InChIKey: IVOMOUWHDPKRLL-BENJYUDCSA-N

Properties

• Boiling point: 701.488°C at 760 mmHg (Cal.)
• Flash point: 378.046°C (Cal.)