(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis[(benzylamino)methyl]-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol | 899426-06-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis[(benzylamino)methyl]-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol
• CAS: 899426-06-3
• 化学式: C₇₈H₁₀₂N₆O₂₄
• 分子量: 1507.69
• InChiKey: PIJKBLPYKHSGMU-KWYFOIMLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.4
• 重原子数：
  108
• 可旋转键数：
  24
• 环数：
  28.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  426
• 氢给体数：
  18
• 氢受体数：
  30

反应信息

• 作为产物：
  描述：

  [1,2,3,4,5,6]O⁶-hexakis-(toluene-4-sulfonyl)-cyclo-lin-hexa[1α=>4]-D-glucopyranosyl 、 苄胺 生成 (1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31R,32R,33R,34R,35R,36R,37R,38R,39R,40R,41R,42R)-5,10,15,20,25,30-hexakis[(benzylamino)methyl]-2,4,7,9,12,14,17,19,22,24,27,29-dodecaoxaheptacyclo[26.2.2.23,6.28,11.213,16.218,21.223,26]dotetracontane-31,32,33,34,35,36,37,38,39,40,41,42-dodecol
  参考文献：
  名称：

  Mimicking an antimicrobial peptidepolymyxin B by use of cyclodextrin

  摘要：

  环糊精衍生物可模拟膜活性抗菌肽多粘菌素 B，具有很强的渗透细菌膜和抑制细菌增殖的作用。

  DOI：

  10.1039/c1cc16369h

文献信息

• Mimicking an antimicrobial peptidepolymyxin B by use of cyclodextrin
  作者：Hatsuo Yamamura、Ken Suzuki、Kazuma Uchibori、Atsushi Miyagawa、Masao Kawai、Chie Ohmizo、Takashi Katsu

  DOI：10.1039/c1cc16369h

  日期：——

  Cyclodextrin derivatives prepared to mimic a membrane active antibacterial peptide polymyxin B strongly permeabilized bacterial membrane and inhibited bacterial proliferation.

  环糊精衍生物可模拟膜活性抗菌肽多粘菌素 B，具有很强的渗透细菌膜和抑制细菌增殖的作用。