N(4)-(N-(6-三氟乙酰基酰胺基己酰)-2-氨基乙基)-5'-O-二甲氧基三苯甲基-5-甲基-2'-脱氧胞苷-3'-N,N-二异丙基甲基亚磷酰胺
[CAS# 117032-52-7]

基本信息

• 产品名称: N(4)-(N-(6-三氟乙酰基酰胺基己酰)-2-氨基乙基)-5'-O-二甲氧基三苯甲基-5-甲基-2'-脱氧胞苷-3'-N,N-二异丙基甲基亚磷酰胺
• 英文名: N(4)-(N-(6-Trifluoroacetylamidocaproyl)-2-aminoethyl)-5'-O-dimethoxytrityl-5-methyl-2'-deoxycytidine-3'-N,N-diisopropylmethylphosphoramidite
• 别名: [(2R,3S,4R,5R)-2-[[Bis(4-Methoxyphenyl)-Phenyl-Methoxy]Methyl]-4-Hydroxy-5-[5-Methyl-2-Oxo-4-[2-[6-[(2,2,2-Trifluoroacetyl)Amino]Hexylideneamino]Ethylamino]Pyrimidin-1-Yl]Tetrahydrofuran-3-Yl]Oxy-N-Tert-Butyl-N-Isopropyl-Phosphonamidic Acid; [(2R,3S,4R,5R)-2-[[Bis(4-Methoxyphenyl)-Phenylmethoxy]Methyl]-4-Hydroxy-5-[5-Methyl-2-Oxo-4-[2-[6-[(2,2,2-Trifluoro-1-Oxoethyl)Amino]Hexylideneamino]Ethylamino]-1-Pyrimidinyl]-3-Tetrahydrofuranyl]Oxy-N-Tert-Butyl-N-Isopropylphosphonamidic Acid; [(2R,3S,4R,5R)-2-[[Bis(4-Methoxyphenyl)-Phenyl-Methoxy]Methyl]-4-Hydroxy-5-[2-Keto-5-Methyl-4-[2-[6-[(2,2,2-Trifluoroacetyl)Amino]Hexylideneamino]Ethylamino]Pyrimidin-1-Yl]Tetrahydrofuran-3-Yl]Oxy-N-Tert-Butyl-N-Isopropyl-Phosphonamidic Acid
• 分子式: C₄₈H₆₄F₃N₆O₁₀P
• 分子量: 973.04
• CAS 登录号: 117032-52-7
• 分子行输入简码 SMILES: [C@@H]2(O[P](=O)(O)N(C(C)(C)C)C(C)C)[C@H](O[C@@H](N1C(=O)N=C(NCCN=CCCCCCNC(=O)C(F)(F)F)C(=C1)C)[C@@H]2O)COC(C3=CC=C(OC)C=C3)(C4=CC=C(OC)C=C4)C5=CC=CC=C5
• 国际化学标识码 InChI: 1S/C48H64F3N6O10P/c1-32(2)57(46(4,5)6)68(61,62)67-41-39(31-65-47(34-16-12-11-13-17-34,35-18-22-37(63-7)23-19-35)36-20-24-38(64-8)25-21-36)66-43(40(41)58)56-30-33(3)42(55-45(56)60)53-29-28-52-26-14-9-10-15-27-54-44(59)48(49,50)51/h11-13,16-26,30,32,39-41,43,58H,9-10,14-15,27-29,31H2,1-8H3,(H,54,59)(H,61,62)(H,53,55,60)/t39-,40-,41-,43-/m1/s1
• 国际化学标识检索码 InChIKey: OCLJXEFIQQRKNC-MMQDZLRKSA-N

物理化学性质

• 密度: 1.285g/cm³ （计算值）