[3-[3-[3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxy-2,2-bis[[3-[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxymethyl]propyl] 7-hydroxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-6-(hydroxymethyl)-2,6-dimethyl-5-oxoheptanoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: [3-[3-[3-Hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxy-2,2-bis[[3-[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxymethyl]propyl] 7-hydroxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-6-(hydroxymethyl)-2,6-dimethyl-5-oxoheptanoate
• 英文别名: [3-[3-[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxy-2,2-bis[[3-[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-2-methylpropanoyl]oxymethyl]propyl] 7-hydroxy-2-[[3-hydroxy-2-(hydroxymethyl)-2-methylpropanoyl]oxymethyl]-6-(hydroxymethyl)-2,6-dimethyl-5-oxoheptanoate
• 化学式: C₆₆H₁₁₀O₃₉
• 分子量: 1527.6
• InChiKey: UDNVGQQNQWJHNU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -7.9
• 重原子数：
  105
• 可旋转键数：
  64
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  630
• 氢给体数：
  16
• 氢受体数：
  39

文献信息

• Dipeptidyl peptidase inhibitors
  申请人：Syrrx, Inc.

  公开号：US20040242568A1

  公开（公告）日：2004-12-02

  Compounds, pharmaceuticals, kits and methods are provided for use with DPP-IV and other S9 proteases that comprise a compound comprising the formula: 1 wherein Q is selected from the group consisting of CO, SO, SO 2 , or C═NR 9 ; and R 1 , R 2 , R 3 and R 4 are as defined herein.

  提供了与DPP-IV和其他S9蛋白酶一起使用的化合物、制药品、试剂盒和方法，其中包括一个包含以下公式的化合物：1 其中Q是从CO、SO、SO2或C═NR9组成的群体中选择的；而R1、R2、R3和R4如此定义。
• CATIONIC POLYMERS FOR ANTIMICROBIAL APPLICATIONS AND DELIVERY OF BIOACTIVE MATERIALS
  申请人：AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH

  公开号：US20140220093A1

  公开（公告）日：2014-08-07

  A cationic star polymer is disclosed of the general formula (1): wherein w′ is a positive number greater than or equal to 3, I′ is a dendritic polyester core covalently linked to w′ independent peripheral linear cationic polymer chains P′. Each of the chains P′ comprises a cationic repeat unit comprising i) a backbone functional group selected from the group consisting of aliphatic carbonates, aliphatic esters, aliphatic carbamates, aliphatic ureas, aliphatic thiocarbamates, aliphatic dithiocarbonates, and combinations thereof, and ii) a side chain comprising a quaternary amine group. The quaternary amine group comprises a divalent methylene group directly covalently linked to i) a positive charged nitrogen and ii) an aromatic ring.

  本发明揭示了一种阳离子星形聚合物，其一般式为(1)：其中w'是大于或等于3的正数，I'是与w'个独立的外周线性阳离子聚合物链P'共价连接的树状聚酯核心。每个链P'包含一个阳离子重复单元，包括：i）选择自脂肪族碳酸酯、脂肪族酯、脂肪族氨基甲酸酯、脂肪族脲、脂肪族硫代氨基甲酸酯、脂肪族二硫代碳酸酯和其组合的骨架功能基；以及ii）包含季铵基的侧链。季铵基包括一个直接共价连接到i）一个带正电的氮和ii）一个芳香环的二价亚甲基基团。