N-(12-aminododecyl)-3,7-dimethylocta-2,6-dienamide | 1394833-42-1

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: N-(12-aminododecyl)-3,7-dimethylocta-2,6-dienamide
• 英文别名: 3,7-dimethyl-octa-2,6-dienoic acid (12-amino-dodecyl)-amide
• CAS: 1394833-42-1
• 化学式: C₂₂H₄₂N₂O
• 分子量: 350.588
• InChiKey: UBFOUUNYDUKYIU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  25
• 可旋转键数：
  16
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.77
• 拓扑面积：
  55.1
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1,12-二氨基十二烷 、 香叶酸 在 (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate 、 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 12.0h， 以59%的产率得到N-(12-aminododecyl)-3,7-dimethylocta-2,6-dienamide
  参考文献：
  名称：

  Polyamino geranic derivatives as new chemosensitizers to combat antibiotic resistant Gram-negative bacteria

  摘要：

  Benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate reagent (BOP) serves as an efficient and versatile coupling reagent for the design and synthesis of new polyamino geranic acid derivatives in moderate to good chemical yields varying from 47% to 83%. These compounds induced a significant decrease of antibiotic resistance in two Gram-negative bacterial MDR strains. Our data suggested that their mechanism of action is closely associated with the inhibition of the efflux pumps. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2012.12.030

文献信息

• Polyamino geranic derivatives as new chemosensitizers to combat antibiotic resistant Gram-negative bacteria
  作者：Jean Michel Brunel、Aurélie Lieutaud、Vincent Lome、Jean-Marie Pagès、Jean-Michel Bolla

  DOI：10.1016/j.bmc.2012.12.030

  日期：2013.3

  Benzotriazol-1-yloxytris(dimethylamino)phosphonium hexafluorophosphate reagent (BOP) serves as an efficient and versatile coupling reagent for the design and synthesis of new polyamino geranic acid derivatives in moderate to good chemical yields varying from 47% to 83%. These compounds induced a significant decrease of antibiotic resistance in two Gram-negative bacterial MDR strains. Our data suggested that their mechanism of action is closely associated with the inhibition of the efflux pumps. (C) 2012 Elsevier Ltd. All rights reserved.