(2R,3R,4S,5R)-5-[[[(2R,3R,4R,5R)-2-[6-[4-[(4-叠氮基-2-硝基苯基)氨基]丁酰基氨基]嘌呤-9-基]-4-羟基-5-[(羟基-膦酰氧基磷酰)氧基甲基]四氢呋喃-3-基]氧基-羟基磷酰]氧基甲基]-2-(3-氨基甲酰吡啶-1-鎓-1-基)-4-羟基四氢呋喃-3-醇
[CAS# 105450-72-4]

基本信息

• 产品名称: (2R,3R,4S,5R)-5-[[[(2R,3R,4R,5R)-2-[6-[4-[(4-叠氮基-2-硝基苯基)氨基]丁酰基氨基]嘌呤-9-基]-4-羟基-5-[(羟基-膦酰氧基磷酰)氧基甲基]四氢呋喃-3-基]氧基-羟基磷酰]氧基甲基]-2-(3-氨基甲酰吡啶-1-鎓-1-基)-4-羟基四氢呋喃-3-醇
• 英文名: (2R,3R,4S,5R)-5-[[[(2R,3R,4R,5R)-2-[6-[4-[(4-Azido-2-Nitrophenyl)Amino]Butanoylamino]Purin-9-Yl]-4-Hydroxy-5-[(Hydroxy-Phosphonooxyphosphoryl)Oxymethyl]Oxolan-3-Yl]Oxy-Hydroxyphosphoryl]Oxymethyl]-2-(3-Carbamoylpyridin-1-Ium-1-Yl)-4-Hydroxyoxolan-3-Olate
• 别名: (2R,3R,4S,5R)-5-[[[(2R,3R,4R,5R)-2-[6-[4-[(4-Azido-2-Nitro-Phenyl)Amino]Butanoylamino]Purin-9-Yl]-4-Hydroxy-5-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Tetrahydrofuran-3-Yl]Oxy-Hydroxy-Phosphoryl]Oxymethyl]-2-(3-Carbamoylpyridin-1-Ium-1-Yl)-4-Hydroxy-Tetrahydrofuran-3-Olate; (2R,3R,4S,5R)-5-[[[(2R,3R,4R,5R)-2-[6-[[4-[(4-Azido-2-Nitrophenyl)Amino]-1-Oxobutyl]Amino]-9-Purinyl]-4-Hydroxy-5-[(Hydroxy-Phosphonooxyphosphoryl)Oxymethyl]-3-Tetrahydrofuranyl]Oxy-Hydroxyphosphoryl]Oxymethyl]-2-(3-Carbamoyl-1-Pyridin-1-Iumyl)-4-Hydroxy-3-Tetrahydrofuranolate; (2R,3R,4S,5R)-2-(3-Aminocarbonylpyridin-1-Ium-1-Yl)-5-[[[(2R,3R,4R,5R)-2-[6-[4-[(4-Azido-2-Nitro-Phenyl)Amino]Butanoylamino]Purin-9-Yl]-4-Hydroxy-5-[(Hydroxy-Phosphonooxy-Phosphoryl)Oxymethyl]Oxolan-3-Yl]Oxy-Hydroxy-Phosphoryl]Oxymethyl]-4-Hydroxy-Oxolan-3-Olate
• 分子式: C₃₁H₃₇N₁₂O₂₀P₃
• 分子量: 990.62
• CAS 登录号: 105450-72-4
• 分子行输入简码 SMILES: [N+](=NC6=CC=C(NCCCC(=O)NC1=NC=NC2=C1N=C[N]2[C@@H]3O[C@@H]([C@@H](O)[C@H]3O[P](OC[C@H]5O[C@@H]([N+]4=CC(=CC=C4)C(=O)N)[C@H]([O-])[C@@H]5O)(=O)O)CO[P](O[P](=O)(O)O)(=O)O)C(=C6)[N+]([O-])=O)=[N-]
• 国际化学标识码 InChI: 1S/C31H37N12O20P3/c32-27(48)15-3-2-8-41(10-15)30-25(47)23(45)19(60-30)11-58-65(54,55)62-26-24(46)20(12-59-66(56,57)63-64(51,52)53)61-31(26)42-14-37-22-28(35-13-36-29(22)42)38-21(44)4-1-7-34-17-6-5-16(39-40-33)9-18(17)43(49)50/h2-3,5-6,8-10,13-14,19-20,23-26,30-31,34,45-46H,1,4,7,11-12H2,(H2,32,48)(H,54,55)(H,56,57)(H2,51,52,53)(H,35,36,38,44)/t19-,20-,23-,24-,25-,26-,30-,31-/m1/s1
• 国际化学标识检索码 InChIKey: GZRHVQOGXJZIAS-YACAAUEQSA-N