6,7-Dihydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-6-Methyl-4,7-Dihydroimidazo[1,2-a]Purin-9-One
[CAS# 159062-85-8]

Identification

• Name: 6,7-Dihydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-6-Methyl-4,7-Dihydroimidazo[1,2-a]Purin-9-One
• Synonyms: 6,7-Dihydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-6-Methyl-4,7-Dihydroimidazo[1,2-A]Purin-9-One; 6,7-Dihydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-6-Methyl-4,7-Dihydroimidazo[1,2-A]Purin-9-One; 6,7-Dihydroxy-3-[(2R,4S,5R)-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-6-Methyl-4,7-Dihydroimidazo[1,2-A]Purin-9-One
• Molecular Formula: C₁₃H₁₇N₅O₆
• Molecular Weight: 339.31
• CAS Registry Number: 159062-85-8
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO)[N]2C4=C(N=C2)C(=O)N3C(=NC(O)(C3O)C)N4
• InChI: 1S/C13H17N5O6/c1-13(23)11(22)18-10(21)8-9(15-12(18)16-13)17(4-14-8)7-2-5(20)6(3-19)24-7/h4-7,11,19-20,22-23H,2-3H2,1H3,(H,15,16)/t5-,6+,7+,11?,13?/m0/s1
• InChIKey: FGUOIKXAPPJNLE-GFAWAZIOSA-N

Properties

• Density: 2.108g/cm³ (Cal.)
• Boiling point: 746.647°C at 760 mmHg (Cal.)
• Flash point: 405.357°C (Cal.)