| 1013933-83-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• CAS: 1013933-83-9
• 化学式: C₇₀H₁₂₅NO₃₅
• 分子量: 1540.75
• InChiKey: WDVRUXDQMROZSF-QQTBTKRASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.34
• 重原子数：
  106.0
• 可旋转键数：
  34.0
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.99
• 拓扑面积：
  342.92
• 氢给体数：
  1.0
• 氢受体数：
  35.0

反应信息

• 作为产物：
  描述：

  辛酸正丁酯 、 mono(6-amino-6-deoxy)-per(2,3,6-O-methyl)-β-cyclodextrin 在 immobilized lipase from Mucor miehei 作用下， 反应 100.0h， 以70%的产率得到
  参考文献：
  名称：

  Lipase-catalyzed synthesis and characterization of novel lipidyl-cyclodextrins in solvent free medium

  摘要：

  The lipase-catalyzed amidation reaction between fatty acyl donors and mono-6-amino-permethylated beta-cyclodextrin (MBCD-NH2) was achieved with high yield in solvent free medium. The ability of Mucor miehie and Candida cylindracea lipases, free or immobilized, to catalyze amidation reaction was shown. Products were purified and characterized. To optimize the reaction, some reaction conditions were assessed like temperature, type of shaking and amount of enzyme, on a model amidation reaction between butyl caprylate and MBCD-NH2. Among the biocatalysts tested, Lipozyme was found to be the most active, requiring low loading, being robust at 70 degrees C even under magnetic agitation. (C) 2010 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcatb.2010.05.013