undecyl ferulate | 259267-44-2

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: undecyl ferulate
• 英文别名: Undecyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate；undecyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
• CAS: 259267-44-2
• 化学式: C₂₁H₃₂O₄
• 分子量: 348.483
• InChiKey: APDRVAYWVPTPAM-UHFFFAOYSA-N

物化性质

• 沸点：
  469.0±30.0 °C(Predicted)
• 密度：
  1.031±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  6.9
• 重原子数：
  25
• 可旋转键数：
  14
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  三乙酰基没食子酰氯 、 undecyl ferulate 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 4.0h， 以67%的产率得到undecyl 3-[4-(3,4,5-triacetyloxybenzoyloxy)-3-methoxyphenyl]-2-propenoate
  参考文献：
  名称：

  Synthesis of Novel Polyphenols Consisted of Ferulic and Gallic Acids, and Their Inhibitory Effects on Phorbol Ester-Induced Epstein–Barr Virus Activation and Superoxide Generation

  摘要：

  We prepared novel polyphenols which were esters composed of two naturally occurring products, ferulic and gallic acids, and investigated their inhibitory effects on 12-O-tetradecanoylphorbol-13-acetate (TPA)-induced Epstein-Barr virus (EBV) activation and superoxide (O-2(-)) generation. Most of these compounds exhibited significant EBV activation suppression at a concentration of 20 muM and in particular, the ester 5f having 2-metyl-1-butyl group showed high activity. The suppressive effects on O-2(-) generation were also observed in most of the esters. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(01)00361-3