[(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 | 402572-01-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 英文名称: [(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
• CAS: 402572-01-4
• 化学式: C₂₂H₂₅BN₇O₇P
• 分子量: 541.268
• InChiKey: BUJGLMPAEWHHBD-QTQZEZTPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.08
• 重原子数：
  38
• 可旋转键数：
  7
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  148
• 氢给体数：
  1
• 氢受体数：
  9

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：

  2-N,2-N,7-trimethylguanosine 5'-O-phosphate 生成 [(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 、 alkaline earth salt of/the/ methylsulfuric acid
  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

文献信息

• Solid-phase synthesis of a 5′-terminal TMG-capped trinucleotide block of U1 snRNA
  作者：Michinori Kadokura、Takeshi Wada、Kohji Seio、Tomohisa Moriguchi、Jochen Huber、Reinhard Lührmann、Mitsuo Sekine

  DOI：10.1016/s0040-4039(01)01941-4

  日期：2001.12

  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.