Adenosine 3'-Diphosphate 5'-Diphosphate
[CAS# 28218-64-6]

Identification

• Name: Adenosine 3'-Diphosphate 5'-Diphosphate
• Synonyms: [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Tetrahydrofuran-3-Yl] Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Amino-9-Purinyl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxyphosphoryl)Oxymethyl]-3-Tetrahydrofuranyl] Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Oxolan-3-Yl] Phosphono Hydrogen Phosphate
• Molecular Formula: C₁₀H₁₇N₅O₁₆P₄
• Molecular Weight: 587.16
• CAS Registry Number: 28218-64-6
• SMILES: [C@H]1(O[C@@H]([C@@H](O[P](O[P](=O)(O)O)(=O)O)[C@H]1O)CO[P](O[P](=O)(O)O)(=O)O)[N]2C3=C(N=C2)C(=NC=N3)N
• InChI: 1S/C10H17N5O16P4/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(29-35(25,26)31-33(20,21)22)4(28-10)1-27-34(23,24)30-32(17,18)19/h2-4,6-7,10,16H,1H2,(H,23,24)(H,25,26)(H2,11,12,13)(H2,17,18,19)(H2,20,21,22)/t4-,6-,7-,10-/m1/s1
• InChIKey: DWZMGWMGGHNJLF-KQYNXXCUSA-N

Properties

• Density: 2.747g/cm³ (Cal.)
• Boiling point: 1060.608°C at 760 mmHg (Cal.)
• Flash point: 595.234°C (Cal.)