(2S,3R)-2-[[(2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]-3-phosphonooxybutanoic acid

• 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: (2S,3R)-2-[[(2Z,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoyl]amino]-3-phosphonooxybutanoic acid
• 化学式: C₂₄H₃₆NO₇P
• 分子量: 481.5
• InChiKey: VVGJHLTYYFDUTP-YRZBBUGQSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  33
• 可旋转键数：
  10
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  133
• 氢给体数：
  4
• 氢受体数：
  7

文献信息

• Polyunsaturated fatty acid derivatives and their use
  申请人：——

  公开号：US20010037032A1

  公开（公告）日：2001-11-01

  Novel amides are disclosed, in particular amides of the all-trans-retinoic acid or 13-cis-retinoic acid and arachidonic acid and docosahexaenoic acid and eicosapentaenoic acid or linoleic acid with 2-aminoethanol, alpha-L-serine, alpha-L-threonine, alpha-L-tyrosine containing phosphate groups. Further, the present invention discloses the synthesis and use of these compounds, in particular their pharmaceutical application.

  本发明公开了新型酰胺，特别是所有-反式-视黄酸或13-顺-视黄酸和花生四烯酸、二十二碳六烯酸、二十碳五烯酸或亚油酸与2-氨基乙醇、α-L-丝氨酸、α-L-苏氨酸、α-L-酪氨酸含磷酸基。此外，本发明还公开了这些化合物的合成和使用，特别是它们在药学上的应用。
• New compounds for the treatment of cancer
  申请人：ARDENIA INVESTMENTS, LTD.

  公开号：US20010018425A1

  公开（公告）日：2001-08-30

  It is shown that the potency of anti-cancer drugs, here exemplified by doxorubicin, can be increased by the use of polyunsaturated fatty acid amides and in particular specific combinations of such compounds, forming complexes with doxorubicin. Further, a modified form of doxorubicin is presented.

  研究表明，使用多不饱和脂肪酸酰胺，特别是这类化合物的特定组合，与多柔比星形成复合物，可以提高抗癌药物（这里以多柔比星为例）的药效。此外，还介绍了一种改良形式的多柔比星。
• POLYUNSATURATED FATTY ACID DERIVATIVES AND THEIR USE
  申请人：Ardenia Investments Ltd.

  公开号：EP1161436A1

  公开（公告）日：2001-12-12
• COMPOUNDS FOR THE TREATMENT OF CANCER
  申请人：Ardenia Investments Ltd.

  公开号：EP1159756A2

  公开（公告）日：2001-12-05
• Polyunsaturated fatty acid derivatives and their use in the treatment of cancer
  申请人：Ardenia Investments Ltd.

  公开号：EP1161436B1

  公开（公告）日：2003-06-25