Misonidazole-Guanosine Product
[CAS# 13351-91-2]

Identification

• Name: Misonidazole-Guanosine Product
• Synonyms: 3-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-6,7-Dihydroxy-6,7-Dihydro-4H-Imidazo[1,2-A]Purin-9-One; 3-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-6,7-Dihydroxy-6,7-Dihydro-4H-Imidazo[1,2-A]Purin-9-One; 3-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-6,7-Dihydroxy-6,7-Dihydro-4H-Imidazo[1,2-A]Purin-9-One
• Molecular Formula: C₁₂H₁₅N₅O₇
• Molecular Weight: 341.28
• CAS Registry Number: 13351-91-2
• SMILES: [C@H]4([N]1C=NC3=C1NC2=NC(C(N2C3=O)O)O)[C@H](O)[C@H](O)[C@H](O4)CO
• InChI: 1S/C12H15N5O7/c18-1-3-5(19)6(20)11(24-3)16-2-13-4-7(16)14-12-15-8(21)10(23)17(12)9(4)22/h2-3,5-6,8,10-11,18-21,23H,1H2,(H,14,15)/t3-,5-,6-,8?,10?,11-/m1/s1
• InChIKey: YWKFWNPQYNRMKR-XNSWJEGQSA-N

Properties

• Density: 2.479g/cm³ (Cal.)
• Boiling point: 827.229°C at 760 mmHg (Cal.)
• Flash point: 454.092°C (Cal.)