Dansylamino deoxy-adenosine triphosphate
[CAS# 80214-45-5]

Identification

• Name: Dansylamino deoxy-adenosine triphosphate
• Synonyms: [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Amino-9-Purinyl)-4-[(5-Dimethylamino-1-Naphthyl)Sulfonylamino]-3-Hydroxy-2-Tetrahydrofuranyl]Methyl (Hydroxy-Phosphonooxyphosphoryl) Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-4-[(5-Dimethylaminonaphthalen-1-Yl)Sulfonylamino]-3-Hydroxy-Oxolan-2-Yl]Methyl (Hydroxy-Phosphonooxy-Phosphoryl) Hydrogen Phosphate
• Molecular Formula: C₂₂H₂₈N₇O₁₄P₃S
• Molecular Weight: 739.48
• CAS Registry Number: 80214-45-5
• SMILES: [C@@H]3(CO[P](O[P](O[P](=O)(O)O)(=O)O)(=O)O)[C@@H](O)[C@@H](N[S](=O)(=O)C1=CC=CC2=C(C=CC=C12)N(C)C)[C@@H](O3)[N]4C=NC5=C4N=CN=C5N
• InChI: 1S/C22H28N7O14P3S/c1-28(2)14-7-3-6-13-12(14)5-4-8-16(13)47(38,39)27-17-19(30)15(9-40-45(34,35)43-46(36,37)42-44(31,32)33)41-22(17)29-11-26-18-20(23)24-10-25-21(18)29/h3-8,10-11,15,17,19,22,27,30H,9H2,1-2H3,(H,34,35)(H,36,37)(H2,23,24,25)(H2,31,32,33)/t15-,17-,19-,22-/m1/s1
• InChIKey: LJBBNUJRGFSTNW-YDVTWLGESA-N

Properties

• Density: 2.03g/cm³ (Cal.)
• Boiling point: 1058.508°C at 760 mmHg (Cal.)
• Flash point: 593.964°C (Cal.)