2-Decyl-5-methoxy-3-methyl-6-(2,3,3-trimethylbutan-2-yloxy)cyclohexa-2,5-diene-1,4-dione

• 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-Decyl-5-methoxy-3-methyl-6-(2,3,3-trimethylbutan-2-yloxy)cyclohexa-2,5-diene-1,4-dione
• 英文别名: 2-decyl-5-methoxy-3-methyl-6-(2,3,3-trimethylbutan-2-yloxy)cyclohexa-2,5-diene-1,4-dione
• 化学式: C₂₅H₄₂O₄
• 分子量: 406.6
• InChiKey: KMJNRHOBNNZXOX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  29
• 可旋转键数：
  13
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

文献信息

• COMPOSITIONS AND METHODS OF TREATING CANCER
  申请人：Spitz Douglas R.

  公开号：US20140228290A1

  公开（公告）日：2014-08-14

  The invention provides compositions and methods to treat cancer with an agent that increases reactive oxygen species (ROS) levels in cancer cell mitochondria (“an XTPP agent”) or a pharmaceutically acceptable salt thereof, an inhibitor of hydroperoxide metabolism and a pharmaceutically acceptable diluent or carrier.