[15-[4-(3-Benzyl-5-hydroxyphenoxy)-3-hydroxy-5-methoxyphenyl]-7-hydroxy-38-(3-hydroxyphenyl)-17-oxo-2-(3-oxobutyl)-2,14,34,42-tetrazaoctacyclo[37.3.1.03,12.06,11.010,14.022,27.022,31.032,36]tritetraconta-1(43),3,5,10,12,23,25,29,32,35,39-undecaen-19-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: [15-[4-(3-Benzyl-5-hydroxyphenoxy)-3-hydroxy-5-methoxyphenyl]-7-hydroxy-38-(3-hydroxyphenyl)-17-oxo-2-(3-oxobutyl)-2,14,34,42-tetrazaoctacyclo[37.3.1.03,12.06,11.010,14.022,27.022,31.032,36]tritetraconta-1(43),3,5,10,12,23,25,29,32,35,39-undecaen-19-yl] acetate
• 英文别名: [15-[4-(3-benzyl-5-hydroxyphenoxy)-3-hydroxy-5-methoxyphenyl]-7-hydroxy-38-(3-hydroxyphenyl)-17-oxo-2-(3-oxobutyl)-2,14,34,42-tetrazaoctacyclo[37.3.1.03,12.06,11.010,14.022,27.022,31.032,36]tritetraconta-1(43),3,5,10,12,23,25,29,32,35,39-undecaen-19-yl] acetate
• 化学式: C₇₁H₇₂N₄O₁₀
• 分子量: 1141.3
• InChiKey: BRASKFBIVDACHF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.8
• 重原子数：
  85
• 可旋转键数：
  12
• 环数：
  12.0
• 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