[9-[3-Hydroxy-4-(3-hydroxyphenoxy)-5-methoxyphenyl]-14-(hydroxymethyl)-24-(3-hydroxyphenyl)-7-oxo-18-(3-oxobutyl)-10,18,20,28-tetrazaoctacyclo[23.13.3.110,13.119,23.02,31.02,35.012,17.026,30]tritetraconta-1(38),11,13(43),14,16,19(42),22,26,29,32,36-undecaen-40-yn-5-yl] acetate

• 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: [9-[3-Hydroxy-4-(3-hydroxyphenoxy)-5-methoxyphenyl]-14-(hydroxymethyl)-24-(3-hydroxyphenyl)-7-oxo-18-(3-oxobutyl)-10,18,20,28-tetrazaoctacyclo[23.13.3.110,13.119,23.02,31.02,35.012,17.026,30]tritetraconta-1(38),11,13(43),14,16,19(42),22,26,29,32,36-undecaen-40-yn-5-yl] acetate
• 英文别名: [9-[3-hydroxy-4-(3-hydroxyphenoxy)-5-methoxyphenyl]-14-(hydroxymethyl)-24-(3-hydroxyphenyl)-7-oxo-18-(3-oxobutyl)-10,18,20,28-tetrazaoctacyclo[23.13.3.110,13.119,23.02,31.02,35.012,17.026,30]tritetraconta-1(38),11,13(43),14,16,19(42),22,26,29,32,36-undecaen-40-yn-5-yl] acetate
• 化学式: C₆₅H₆₄N₄O₁₀
• 分子量: 1061.2
• InChiKey: KYGWQVNAWUEFKV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  79
• 可旋转键数：
  11
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  196
• 氢给体数：
  6
• 氢受体数：
  12