3-[31-Cyclopentyl-7-(diaminomethylideneamino)-2,9,17-trihydroxy-1,20,20,24,28-pentamethyl-21,26-dioxo-18-(2-phenylethenyl)-9-nonacyclo[15.11.1.13,10.14,8.02,15.04,28.019,24.025,29.013,30]hentriaconta-5,10,13(30),15,25(29)-pentaenyl]-2-methylprop-2-enoic 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: 3-[31-Cyclopentyl-7-(diaminomethylideneamino)-2,9,17-trihydroxy-1,20,20,24,28-pentamethyl-21,26-dioxo-18-(2-phenylethenyl)-9-nonacyclo[15.11.1.13,10.14,8.02,15.04,28.019,24.025,29.013,30]hentriaconta-5,10,13(30),15,25(29)-pentaenyl]-2-methylprop-2-enoic acid
• 英文别名: 3-[31-cyclopentyl-7-(diaminomethylideneamino)-2,9,17-trihydroxy-1,20,20,24,28-pentamethyl-21,26-dioxo-18-(2-phenylethenyl)-9-nonacyclo[15.11.1.13,10.14,8.02,15.04,28.019,24.025,29.013,30]hentriaconta-5,10,13(30),15,25(29)-pentaenyl]-2-methylprop-2-enoic acid
• 化学式: C₅₄H₆₃N₃O₇
• 分子量: 866.1
• InChiKey: ZPNROQNNGCZZQY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  64
• 可旋转键数：
  6
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  197
• 氢给体数：
  6
• 氢受体数：
  8