18-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,13,38-trihydroxy-43-[3-hydroxy-5-(methylaminomethyl)phenyl]-23,28,38-trimethyl-40-azadodecacyclo[31.7.4.11,28.14,8.19,15.110,14.03,23.03,27.020,24.029,43.019,46.033,45]octatetraconta-6,11,16,20(24),30-pentaene-21,44-dione

• 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: 18-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,13,38-trihydroxy-43-[3-hydroxy-5-(methylaminomethyl)phenyl]-23,28,38-trimethyl-40-azadodecacyclo[31.7.4.11,28.14,8.19,15.110,14.03,23.03,27.020,24.029,43.019,46.033,45]octatetraconta-6,11,16,20(24),30-pentaene-21,44-dione
• 英文别名: 18-[[3-[2-[3-amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-5,13,38-trihydroxy-43-[3-hydroxy-5-(methylaminomethyl)phenyl]-23,28,38-trimethyl-40-azadodecacyclo[31.7.4.11,28.14,8.19,15.110,14.03,23.03,27.020,24.029,43.019,46.033,45]octatetraconta-6,11,16,20(24),30-pentaene-21,44-dione
• 化学式: C₇₇H₁₀₁N₃O₈
• 分子量: 1196.6
• InChiKey: CUFNDRCOHJZJDA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.3
• 重原子数：
  88
• 可旋转键数：
  9
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  198
• 氢给体数：
  8
• 氢受体数：
  11