21-[2-[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-2-hydroxyethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-36-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,25,30-trimethyl-8-azaoctacyclo[29.3.2.11,9.011,25.011,29.015,20.022,26.030,37]heptatriaconta-22(26),32-diene-23,35-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: 21-[2-[3-[2-[3-Amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-2-hydroxyethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-36-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,25,30-trimethyl-8-azaoctacyclo[29.3.2.11,9.011,25.011,29.015,20.022,26.030,37]heptatriaconta-22(26),32-diene-23,35-dione
• 英文别名: 21-[2-[3-[2-[3-amino-5-(2-methylpropyl)phenyl]cyclopentyl]-3-methyloxiran-2-yl]-2-hydroxyethyl]-6-hydroxy-12,18-bis(hydroxymethyl)-36-[3-hydroxy-5-(methylaminomethyl)phenyl]-6,25,30-trimethyl-8-azaoctacyclo[29.3.2.11,9.011,25.011,29.015,20.022,26.030,37]heptatriaconta-22(26),32-diene-23,35-dione
• 化学式: C₆₉H₉₉N₃O₈
• 分子量: 1098.5
• InChiKey: VYHYHEVPVILPIS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  80
• 可旋转键数：
  12
• 环数：
  13.0
• 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