mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-β-cyclodextrin

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-β-cyclodextrin
• 英文别名: N-[2-[[(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecahydroxy-10,15,20,25,30,35-hexakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.23,6.28,11.213,16.218,21.223,26.228,31]nonatetracontan-5-yl]methylamino]ethyl]anthracene-9-carboxamide
• 化学式: C₅₉H₈₄N₂O₃₅
• 分子量: 1381.31
• InChiKey: PTMLLQDCCDLPGE-VAIYENIRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -11.3
• 重原子数：
  96
• 可旋转键数：
  12
• 环数：
  24.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  575
• 氢给体数：
  22
• 氢受体数：
  36

反应信息

• 作为反应物：
  描述：

  mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-β-cyclodextrin 、 足球烯 以 N,N-二甲基甲酰胺 、 甲苯 为溶剂， 反应 48.0h， 以14%的产率得到
  参考文献：
  名称：

  A water-soluble β-cyclodextrin derivative possessing a fullerene tether as an efficient photodriven DNA-cleavage reagent

  摘要：

  A simple synthetic route for a water-soluble cyclodextrin-fullerene conjugate based on the Diels-Alder reaction between anthryl-cyclodextrin and fullerene has been presented. Aided by the fascinating biochemical functions of fullerene, the resultant cyclodextrin-C-60 conjugate displays a satisfactory DNA-cleavage ability under the visible-light irradiation. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.01.181
• 作为产物：
  描述：

  9-蒽甲酸 、 mono-6-deoxy-6-(2-aminoethylamino)-β-cyclodextrin 在 4 A molecular sieve 、 N,N'-二环己基碳二亚胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 96.0h， 以36%的产率得到mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-β-cyclodextrin
  参考文献：
  名称：

  A water-soluble β-cyclodextrin derivative possessing a fullerene tether as an efficient photodriven DNA-cleavage reagent

  摘要：

  A simple synthetic route for a water-soluble cyclodextrin-fullerene conjugate based on the Diels-Alder reaction between anthryl-cyclodextrin and fullerene has been presented. Aided by the fascinating biochemical functions of fullerene, the resultant cyclodextrin-C-60 conjugate displays a satisfactory DNA-cleavage ability under the visible-light irradiation. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.01.181

文献信息

• A water-soluble β-cyclodextrin derivative possessing a fullerene tether as an efficient photodriven DNA-cleavage reagent
  作者：Yu Liu、Yan-Li Zhao、Yong Chen、Peng Liang、Li Li

  DOI：10.1016/j.tetlet.2005.01.181

  日期：2005.4

  A simple synthetic route for a water-soluble cyclodextrin-fullerene conjugate based on the Diels-Alder reaction between anthryl-cyclodextrin and fullerene has been presented. Aided by the fascinating biochemical functions of fullerene, the resultant cyclodextrin-C-60 conjugate displays a satisfactory DNA-cleavage ability under the visible-light irradiation. (c) 2005 Elsevier Ltd. All rights reserved.