Phosphorochloridous acid (2R,3R,4R,5R)-5-(6-benzoylamino-purin-9-yl)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-(tert-butyl-dimethyl-silanyloxy)-tetrahydro-furan-3-yl ester 2-cyano-ethyl ester | 1053613-32-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: Phosphorochloridous acid (2R,3R,4R,5R)-5-(6-benzoylamino-purin-9-yl)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-(tert-butyl-dimethyl-silanyloxy)-tetrahydro-furan-3-yl ester 2-cyano-ethyl ester
• 英文别名: N-[9-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-[chloro(2-cyanoethoxy)phosphanyl]oxyoxolan-2-yl]purin-6-yl]benzamide
• CAS: 1053613-32-3
• 化学式: C₄₇H₅₂ClN₆O₈PSi
• 分子量: 923.478
• InChiKey: MBGIAHQBVNDFRA-VNTGMUHVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.17
• 重原子数：
  64
• 可旋转键数：
  19
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  161
• 氢给体数：
  1
• 氢受体数：
  12

反应信息

• 作为反应物：
  描述：

  [(3aR,4R,6R,6aS)-4-[2-(dimethylamino)-7-methyl-6-oxo-1H-purin-9-ium-9-yl]-2-phenyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3,2]dioxaborol-6-yl]methoxy-imidazol-1-ylphosphinate 、 Phosphorochloridous acid (2R,3R,4R,5R)-5-(6-benzoylamino-purin-9-yl)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-(tert-butyl-dimethyl-silanyloxy)-tetrahydro-furan-3-yl ester 2-cyano-ethyl ester 、 alkaline earth salt of/the/ methylsulfuric acid 生成
  参考文献：
  名称：

  Solid-phase synthesis of a 5′-terminal TMG-capped trinucleotide block of U1 snRNA

  摘要：

  A 5'-terminal 2,2,7-trimethylguanosine-capped trinucleotide block (m(3)(2,2,7)G(5')pppAmpUmpA) was successfully synthesized on a highly cross-linked polystyrene resin by a new method for introduction of the first nucleoside onto the resin and a newly developed pyrophosphorylating agent having a benzotriazolyloxy substitutent as the leaving group. (C) 2001 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(01)01941-4
• 作为产物：
  描述：

  N-[9-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-[2-cyanoethoxy(oxido)phosphaniumyl]oxyoxolan-2-yl]purin-6-yl]benzamide 在 二氯-三(2,4,6-三溴苯氧基)膦烷 作用下， 以 吡啶 为溶剂， 反应 0.08h， 生成 Phosphorochloridous acid (2R,3R,4R,5R)-5-(6-benzoylamino-purin-9-yl)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-(tert-butyl-dimethyl-silanyloxy)-tetrahydro-furan-3-yl ester 2-cyano-ethyl ester
  参考文献：
  名称：

  Solid-phase synthesis of a 5′-terminal TMG-capped trinucleotide block of U1 snRNA

  摘要：

  A 5'-terminal 2,2,7-trimethylguanosine-capped trinucleotide block (m(3)(2,2,7)G(5')pppAmpUmpA) was successfully synthesized on a highly cross-linked polystyrene resin by a new method for introduction of the first nucleoside onto the resin and a newly developed pyrophosphorylating agent having a benzotriazolyloxy substitutent as the leaving group. (C) 2001 Published by Elsevier Science Ltd.

  DOI：

  10.1016/s0040-4039(01)01941-4