4-Benzyl-16-[3,4-dihydroxy-2-(4-imidazolidin-4-ylcyclohex-2-en-1-yl)butyl]-38-hydroxy-24,35,35-trimethyl-15,19,22,30,34-pentaoxadecacyclo[21.15.0.01,27.02,7.010,18.013,17.018,24.021,23.028,33.028,36]octatriaconta-13,16-dien-8-yne-20,31,37-trione

• 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: 4-Benzyl-16-[3,4-dihydroxy-2-(4-imidazolidin-4-ylcyclohex-2-en-1-yl)butyl]-38-hydroxy-24,35,35-trimethyl-15,19,22,30,34-pentaoxadecacyclo[21.15.0.01,27.02,7.010,18.013,17.018,24.021,23.028,33.028,36]octatriaconta-13,16-dien-8-yne-20,31,37-trione
• 英文别名: 4-benzyl-16-[3,4-dihydroxy-2-(4-imidazolidin-4-ylcyclohex-2-en-1-yl)butyl]-38-hydroxy-24,35,35-trimethyl-15,19,22,30,34-pentaoxadecacyclo[21.15.0.01,27.02,7.010,18.013,17.018,24.021,23.028,33.028,36]octatriaconta-13,16-dien-8-yne-20,31,37-trione
• 化学式: C₅₆H₆₈N₂O₁₁
• 分子量: 945.1
• InChiKey: RBWVJZOOBMGPRJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  69
• 可旋转键数：
  8
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  189
• 氢给体数：
  5
• 氢受体数：
  13