[12,24,29-Trihydroxy-27-(2-hydroxypropylamino)-7,35-dimethyl-20-oxo-21,39-dioxadecacyclo[30.4.1.11,33.124,28.03,8.03,16.06,17.011,16.013,36.022,29]nonatriaconta-4,14,25,30,32(37)-pentaen-23-yl] 2-[[7-(2-hydroxyethyl)-2-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

• 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: [12,24,29-Trihydroxy-27-(2-hydroxypropylamino)-7,35-dimethyl-20-oxo-21,39-dioxadecacyclo[30.4.1.11,33.124,28.03,8.03,16.06,17.011,16.013,36.022,29]nonatriaconta-4,14,25,30,32(37)-pentaen-23-yl] 2-[[7-(2-hydroxyethyl)-2-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
• 英文别名: [12,24,29-trihydroxy-27-(2-hydroxypropylamino)-7,35-dimethyl-20-oxo-21,39-dioxadecacyclo[30.4.1.11,33.124,28.03,8.03,16.06,17.011,16.013,36.022,29]nonatriaconta-4,14,25,30,32(37)-pentaen-23-yl] 2-[[7-(2-hydroxyethyl)-2-(hydroxymethyl)-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
• 化学式: C₆₆H₈₁NO₁₃
• 分子量: 1096.3
• InChiKey: RFOLPPRNLFAOGQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  80
• 可旋转键数：
  13
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  225
• 氢给体数：
  8
• 氢受体数：
  14