[(2R,3R,4R,5R)-2-(6-氨基嘌呤-9-基)-4-[(2R,3R,4R,5R,6R)-3-羟基-6-(羟基甲基)-4,5-二膦酰氧基四氢吡喃-2-基]氧基-5-(羟基甲基)四氢呋喃-3-基]磷酸二氢酯
[CAS# 149091-92-9]

基本信息

• 产品名称: [(2R,3R,4R,5R)-2-(6-氨基嘌呤-9-基)-4-[(2R,3R,4R,5R,6R)-3-羟基-6-(羟基甲基)-4,5-二膦酰氧基四氢吡喃-2-基]氧基-5-(羟基甲基)四氢呋喃-3-基]磷酸二氢酯
• 英文名: [(2R,3R,4R,5R)-2-(6-Aminopurin-9-Yl)-4-[(2R,3R,4R,5R,6R)-3-Hydroxy-6-(Hydroxymethyl)-4,5-Diphosphonooxyoxan-2-Yl]Oxy-5-(Hydroxymethyl)Oxolan-3-Yl] Dihydrogen Phosphate
• 别名: [(2R,3R,4R,5R)-2-(6-Aminopurin-9-Yl)-4-[(2R,3R,4R,5R,6R)-3-Hydroxy-6-(Hydroxymethyl)-4,5-Diphosphonooxy-Tetrahydropyran-2-Yl]Oxy-5-(Hydroxymethyl)Tetrahydrofuran-3-Yl] Dihydrogen Phosphate; [(2R,3R,4R,5R)-2-(6-Amino-9-Purinyl)-4-[[(2R,3R,4R,5R,6R)-3-Hydroxy-6-(Hydroxymethyl)-4,5-Diphosphonooxy-2-Tetrahydropyranyl]Oxy]-5-(Hydroxymethyl)-3-Tetrahydrofuranyl] Dihydrogen Phosphate; [(2R,3R,4R,5R)-2-(6-Aminopurin-9-Yl)-4-[(2R,3R,4R,5R,6R)-3-Hydroxy-6-Methylol-4,5-Diphosphonooxy-Tetrahydropyran-2-Yl]Oxy-5-Methylol-Tetrahydrofuran-3-Yl] Dihydrogen Phosphate
• 分子式: C₁₆H₂₆N₅O₁₈P₃
• 分子量: 669.33
• CAS 登录号: 149091-92-9
• 分子行输入简码 SMILES: [C@H]4([N]2C1=NC=NC(=C1N=C2)N)[C@@H]([C@H](O[C@@H]3[C@@H]([C@@H](O[P](=O)(O)O)[C@@H]([C@H](O3)CO)O[P](=O)(O)O)O)[C@H](O4)CO)O[P](=O)(O)O
• 国际化学标识码 InChI: 1S/C16H26N5O18P3/c17-13-7-14(19-3-18-13)21(4-20-7)15-12(39-42(31,32)33)9(5(1-22)34-15)36-16-8(24)11(38-41(28,29)30)10(6(2-23)35-16)37-40(25,26)27/h3-6,8-12,15-16,22-24H,1-2H2,(H2,17,18,19)(H2,25,26,27)(H2,28,29,30)(H2,31,32,33)/t5-,6-,8-,9-,10-,11-,12-,15-,16-/m1/s1
• 国际化学标识检索码 InChIKey: RENVITLQVBEFDT-MZQFDOALSA-N

物理化学性质

• 密度: 2.529g/cm³ （计算值）
• 沸点: 1155.606°C at 760 mmHg （计算值）
• 闪点: 652.687°C （计算值）