Methyl 1-(5-Fluoro-1H-2-Oxopyrimidin-4-Yl)-beta-D-Glucopyranuronate
[CAS# 64977-52-2]

Identification

• Name: Methyl 1-(5-Fluoro-1H-2-Oxopyrimidin-4-Yl)-beta-D-Glucopyranuronate
• Synonyms: Methyl (2S,3S,4S,5R,6S)-6-[(5-Fluoro-2-Oxo-3H-Pyrimidin-4-Yl)Oxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylate; (2S,3S,4S,5R,6S)-6-[(5-Fluoro-2-Oxo-3H-Pyrimidin-4-Yl)Oxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid Methyl Ester; (2S,3S,4S,5R,6S)-6-[(5-Fluoro-2-Keto-3H-Pyrimidin-4-Yl)Oxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid Methyl Ester
• Molecular Formula: C₁₁H₁₃FN₂O₈
• Molecular Weight: 320.23
• CAS Registry Number: 64977-52-2
• SMILES: [C@@H]1([C@@H]([C@H]([C@@H](O[C@@H]1C(=O)OC)OC2=C(C=NC(N2)=O)F)O)O)O
• InChI: 1S/C11H13FN2O8/c1-20-9(18)7-5(16)4(15)6(17)10(21-7)22-8-3(12)2-13-11(19)14-8/h2,4-7,10,15-17H,1H3,(H,13,14,19)/t4-,5-,6+,7-,10-/m0/s1
• InChIKey: OEAJKPYORNFNEN-XOEVEMGQSA-N

Properties

• Density: 1.883g/cm³ (Cal.)