lapachol palmitate | 1539288-19-1

• 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: lapachol palmitate
• 英文别名: [3-(3-Methylbut-2-enyl)-1,4-dioxonaphthalen-2-yl] hexadecanoate；[3-(3-methylbut-2-enyl)-1,4-dioxonaphthalen-2-yl] hexadecanoate
• CAS: 1539288-19-1
• 化学式: C₃₁H₄₄O₄
• 分子量: 480.688
• InChiKey: MYFHSCRFFDDQCC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  35
• 可旋转键数：
  18
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  60.4
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  黄钟花醌 、 棕榈酰氯 在 三乙胺 作用下， 以 乙醚 为溶剂， 反应 0.5h， 生成 lapachol palmitate
  参考文献：
  名称：

  Growth inhibitory activity for cancer cell lines of lapachol and its natural and semi-synthetic derivatives

  摘要：

  A series of 17 selected natural and semisynthetic 1,4-naphthoquinones were synthesized, and their growth inhibitory activity was evaluated in vitro. The compounds were tested on six human cancer cell lines using the MTT colorimetric assay. The data revealed that of the chemicals under study only lapachol, its acetate and 3-geranyllawsone displayed the highest activity, recording mean IC50 values ranging from 15 to 22 mu M. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.12.049

文献信息

• Growth inhibitory activity for cancer cell lines of lapachol and its natural and semi-synthetic derivatives
  作者：Serena Fiorito、Francesco Epifano、Céline Bruyère、Véronique Mathieu、Robert Kiss、Salvatore Genovese

  DOI：10.1016/j.bmcl.2013.12.049

  日期：2014.1

  A series of 17 selected natural and semisynthetic 1,4-naphthoquinones were synthesized, and their growth inhibitory activity was evaluated in vitro. The compounds were tested on six human cancer cell lines using the MTT colorimetric assay. The data revealed that of the chemicals under study only lapachol, its acetate and 3-geranyllawsone displayed the highest activity, recording mean IC50 values ranging from 15 to 22 mu M. (C) 2013 Elsevier Ltd. All rights reserved.