Copper Adenosine Triphosphate
[CAS# 18925-86-5]

Identification

• Name: Copper Adenosine Triphosphate
• Synonyms: Copper (2R,3R,4S,5R)-2-(6-Aminopurin-9-Yl)-5-[[Hydroxy-(Hydroxy-Phosphonooxy-Phosphoryl)Oxy-Phosphoryl]Oxymethyl]Tetrahydrofuran-3,4-Diolate; Copper (2R,3R,4S,5R)-2-(6-Aminopurin-9-Yl)-5-[[Hydroxy-(Hydroxy-Phosphonooxyphosphoryl)Oxyphosphoryl]Oxymethyl]Tetrahydrofuran-3,4-Diolate; Cupric (2R,3R,4S,5R)-2-Adenin-9-Yl-5-[[Hydroxy-(Hydroxy-Phosphonooxy-Phosphoryl)Oxy-Phosphoryl]Oxymethyl]Tetrahydrofuran-3,4-Diolate
• Molecular Formula: C₁₀H₁₄CuN₅O₁₃P₃
• Molecular Weight: 568.71
• CAS Registry Number: 18925-86-5
• SMILES: [C@H]1(O[C@@H]([C@@H]([O-])[C@H]1[O-])CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)[N]2C3=C(N=C2)C(=NC=N3)N.[Cu++]
• InChI: 1S/C10H14N5O13P3.Cu/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20;/h2-4,6-7,10H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20);/q-2;+2/t4-,6-,7-,10-;/m1./s1
• InChIKey: WGLPTDWXNJFVTC-MCDZGGTQSA-N

Properties

• Boiling point: 951.4°C at 760 mmHg (Cal.)
• Flash point: 529.2°C (Cal.)