5-Amino-6-(beta-D-Glucopyranosyl-Amino)-2-Methoxy-4(1H)-Pyrimidinone
[CAS# 95931-87-6]

Identification

• Name: 5-Amino-6-(beta-D-Glucopyranosyl-Amino)-2-Methoxy-4(1H)-Pyrimidinone
• Synonyms: 5-Amino-2-Methoxy-6-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Amino]-1H-Pyrimidin-4-One; 5-Amino-2-Methoxy-6-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Amino]-1H-Pyrimidin-4-One; 5-Amino-2-Methoxy-6-[(3,4,5-Trihydroxy-6-Methylol
• Molecular Formula: C₁₁H₁₈N₄O₇
• Molecular Weight: 318.29
• CAS Registry Number: 95931-87-6
• SMILES: C(O)C2OC(NC1=C(N)C(=O)N=C(OC)N1)C(O)C(O)C2O
• InChI: 1S/C11H18N4O7/c1-21-11-14-8(4(12)9(20)15-11)13-10-7(19)6(18)5(17)3(2-16)22-10/h3,5-7,10,16-19H,2,12H2,1H3,(H2,13,14,15,20)
• InChIKey: VSJOLCXIFHQZRD-UHFFFAOYSA-N

Properties

• Density: 1.963g/cm³ (Cal.)
• Boiling point: 548.417°C at 760 mmHg (Cal.)
• Flash point: 285.473°C (Cal.)