(2S,3S,4S,5R,6R)-6-[[(2S,3S,5R)-3-Amino-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]-3,4,5-Trihydroxyoxane-2-Carboxylic Acid
[CAS# 133632-85-6]

Identification

• Name: (2S,3S,4S,5R,6R)-6-[[(2S,3S,5R)-3-Amino-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methoxy]-3,4,5-Trihydroxyoxane-2-Carboxylic Acid
• Synonyms: (2S,3S,4S,5R,6R)-6-[[(2S,3S,5R)-3-Amino-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-6-[[(2S,3S,5R)-3-Amino-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methoxy]-3,4,5-Trihydroxy-2-Tetrahydropyrancarboxylic Acid; (2S,3S,4S,5R,6R)-6-[[(2S,3S,5R)-3-Amino-5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methoxy]-3,4,5-Trihydroxy-Tetrahydropyran-2-Carboxylic Acid
• Molecular Formula: C₁₆H₂₃N₃O₁₀
• Molecular Weight: 417.37
• CAS Registry Number: 133632-85-6
• SMILES: [C@H]1(O[C@@H]([C@@H](N)C1)CO[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(=O)O)N3C(=O)NC(=O)C(=C3)C
• InChI: 1S/C16H23N3O10/c1-5-3-19(16(26)18-13(5)23)8-2-6(17)7(28-8)4-27-15-11(22)9(20)10(21)12(29-15)14(24)25/h3,6-12,15,20-22H,2,4,17H2,1H3,(H,24,25)(H,18,23,26)/t6-,7+,8+,9-,10-,11+,12-,15+/m0/s1
• InChIKey: XOYCLJDJUKHHHS-LHBOOPKSSA-N

Properties

• Density: 1.668g/cm³ (Cal.)