[(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl (2R,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl Dihydrogen Diphosphate
[CAS# 15839-74-4]

Identification

• Name: [(2R,3S,4R,5R)-5-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methyl (2R,3S,4S,5S,6R)-3,4,5-Trihydroxy-6-Methyltetrahydro-2H-Pyran-2-Yl Dihydrogen Diphosphate
• Synonyms: 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1-METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)-8,9-DIHYDROXY-7-(SEC-BUTYL)-ANTHRACENE; DXA; GDP-6-deoxy-D-mannose
• Molecular Formula: C₁₆H₂₅N₅O₁₅P₂
• Molecular Weight: 589.34
• CAS Registry Number: 15839-74-4
• SMILES: O=P(O[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@@H]1O)C)(O)OP(=O)(O)OC[C@H]4O[C@@H](n2c3NC(=N/C(=O)c3nc2)\N)[C@H](O)[C@@H]4O
• InChI: 1S/C16H25N5O15P2/c1-4-7(22)9(24)11(26)15(33-4)35-38(30,31)36-37(28,29)32-2-5-8(23)10(25)14(34-5)21-3-18-6-12(21)19-16(17)20-13(6)27/h3-5,7-11,14-15,22-26H,2H2,1H3,(H,28,29)(H,30,31)(H3,17,19,20,27)/t4-,5-,7-,8-,9+,10-,11+,14-,15-/m1/s1
• InChIKey: LQEBEXMHBLQMDB-GDJBGNAASA-N

Properties

• Density: 2.43g/cm³ (Cal.)
• Boiling point: 1006.611°C at 760 mmHg (Cal.)
• Flash point: 562.578°C (Cal.)
• Refractive index: 1.869 (Cal.)