[2-acetamido-4-[(1E,3S)-3-ethenyl-3,7-dimethylocta-1,6-dienyl]phenyl] acetate | 1026776-62-4

• 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: [2-acetamido-4-[(1E,3S)-3-ethenyl-3,7-dimethylocta-1,6-dienyl]phenyl] acetate
• CAS: 1026776-62-4
• 化学式: C₂₂H₂₉NO₃
• 分子量: 355.477
• InChiKey: YXVLESVPDLNMKM-XSEIIIHRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  26
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.36
• 拓扑面积：
  55.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-Aminobakuchiol 、 乙酸酐 在 吡啶 作用下， 以99%的产率得到[2-acetamido-4-[(1E,3S)-3-ethenyl-3,7-dimethylocta-1,6-dienyl]phenyl] acetate
  参考文献：
  名称：

  Synthesis and structure–immunosuppressive activity relationships of bakuchiol and its derivatives

  摘要：

  A series of derivatives of bakuchiol were synthesized and tested in vitro for their cytotoxicity, and inhibition of T cell proliferation and B cell proliferation. The data obtained provided preliminary structure-activity relationships of the compounds as immunosuppressive activity. (C) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2007.11.054

文献信息

• Synthesis and structure–immunosuppressive activity relationships of bakuchiol and its derivatives
  作者：Hongli Chen、Xiaolong Du、Wei Tang、Yu Zhou、Jianping Zuo、Huijin Feng、Yuanchao Li

  DOI：10.1016/j.bmc.2007.11.054

  日期：2008.3

  A series of derivatives of bakuchiol were synthesized and tested in vitro for their cytotoxicity, and inhibition of T cell proliferation and B cell proliferation. The data obtained provided preliminary structure-activity relationships of the compounds as immunosuppressive activity. (C) 2007 Elsevier Ltd. All rights reserved.