22-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27,32-trimethyl-13-(3-methylbutyl)-8-azanonacyclo[31.3.2.11,9.115,19.011,27.011,31.024,28.023,39.032,40]tetraconta-20,24(28),34-triene-25,37-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: 22-[[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27,32-trimethyl-13-(3-methylbutyl)-8-azanonacyclo[31.3.2.11,9.115,19.011,27.011,31.024,28.023,39.032,40]tetraconta-20,24(28),34-triene-25,37-dione
• 英文别名: 22-[[3-[2-[3-amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-hydroxymethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-38-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,27,32-trimethyl-13-(3-methylbutyl)-8-azanonacyclo[31.3.2.11,9.115,19.011,27.011,31.024,28.023,39.032,40]tetraconta-20,24(28),34-triene-25,37-dione
• 化学式: C₇₆H₁₀₉N₃O₈
• 分子量: 1192.7
• InChiKey: ZJXQRIYMVJPMPF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.5
• 重原子数：
  87
• 可旋转键数：
  14
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  198
• 氢给体数：
  8
• 氢受体数：
  11