[(2R,3S,4R,5R)-5-(4-氨基-2-氧代嘧啶-1-基)-4-羟基-2-[(羟基-膦酰氧基磷酰)氧基甲基]四氢呋喃-3-基]膦酰氢磷酸酯
[CAS# 73205-34-2]

基本信息

• 产品名称: [(2R,3S,4R,5R)-5-(4-氨基-2-氧代嘧啶-1-基)-4-羟基-2-[(羟基-膦酰氧基磷酰)氧基甲基]四氢呋喃-3-基]膦酰氢磷酸酯
• 英文名: [(2R,3S,4R,5R)-5-(4-Amino-2-Oxopyrimidin-1-Yl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxyphosphoryl)Oxymethyl]Oxolan-3-Yl] Phosphono Hydrogen Phosphate
• 别名: [(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Tetrahydrofuran-3-Yl] Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(4-Amino-2-Oxo-1-Pyrimidinyl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxyphosphoryl)Oxymethyl]-3-Tetrahydrofuranyl] Phosphono Hydrogen Phosphate; [(2R,3S,4R,5R)-5-(4-Amino-2-Keto-Pyrimidin-1-Yl)-4-Hydroxy-2-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Tetrahydrofuran-3-Yl] Phosphono Hydrogen Phosphate
• 分子式: C₉H₁₇N₃O₁₇P₄
• 分子量: 563.14
• CAS 登录号: 73205-34-2
• 分子行输入简码 SMILES: [C@H]1(O[P](O[P](=O)(O)O)(=O)O)[C@@H](O)[C@@H](O[C@@H]1CO[P](O[P](=O)(O)O)(=O)O)N2C(=O)N=C(N)C=C2
• 国际化学标识码 InChI: 1S/C9H17N3O17P4/c10-5-1-2-12(9(14)11-5)8-6(13)7(27-33(23,24)29-31(18,19)20)4(26-8)3-25-32(21,22)28-30(15,16)17/h1-2,4,6-8,13H,3H2,(H,21,22)(H,23,24)(H2,10,11,14)(H2,15,16,17)(H2,18,19,20)/t4-,6-,7-,8-/m1/s1
• 国际化学标识检索码 InChIKey: KCYLRYJAQINMGQ-XVFCMESISA-N

物理化学性质

• 密度: 2.63g/cm³ （计算值）
• 沸点: 962.956°C at 760 mmHg （计算值）
• 闪点: 536.177°C （计算值）