11-[[3-[2-(3-Aminophenyl)cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-27-hydroxy-21-(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27-dimethyl-25-azanonacyclo[30.4.3.11,24.110,14.02,22.05,9.06,22.018,41.032,40]hentetracont-5(9)-ene-8,39-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: 11-[[3-[2-(3-Aminophenyl)cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-27-hydroxy-21-(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27-dimethyl-25-azanonacyclo[30.4.3.11,24.110,14.02,22.05,9.06,22.018,41.032,40]hentetracont-5(9)-ene-8,39-dione
• 英文别名: 11-[[3-[2-(3-aminophenyl)cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-27-hydroxy-21-(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27-dimethyl-25-azanonacyclo[30.4.3.11,24.110,14.02,22.05,9.06,22.018,41.032,40]hentetracont-5(9)-ene-8,39-dione
• 化学式: C₆₆H₉₃N₃O₇
• 分子量: 1040.5
• InChiKey: KCNZUVJWKRNYFI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.9
• 重原子数：
  76
• 可旋转键数：
  8
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.76
• 拓扑面积：
  178
• 氢给体数：
  7
• 氢受体数：
  10