4,6,8,9,29,36-Hexahydroxy-3,12,16,17,31,39,43,44-octamethyl-19,46-bis(2-methylpropyl)-7,26,54-trioxa-20,47-diazatetradecacyclo[27.23.1.18,24.133,52.01,32.02,25.02,28.06,28.014,22.018,22.034,51.041,49.045,49.027,55]pentapentaconta-3,12,15,31,39,42-hexaene-5,21,23,30,35,48,50,53-octone

• 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: 4,6,8,9,29,36-Hexahydroxy-3,12,16,17,31,39,43,44-octamethyl-19,46-bis(2-methylpropyl)-7,26,54-trioxa-20,47-diazatetradecacyclo[27.23.1.18,24.133,52.01,32.02,25.02,28.06,28.014,22.018,22.034,51.041,49.045,49.027,55]pentapentaconta-3,12,15,31,39,42-hexaene-5,21,23,30,35,48,50,53-octone
• 英文别名: 4,6,8,9,29,36-hexahydroxy-3,12,16,17,31,39,43,44-octamethyl-19,46-bis(2-methylpropyl)-7,26,54-trioxa-20,47-diazatetradecacyclo[27.23.1.18,24.133,52.01,32.02,25.02,28.06,28.014,22.018,22.034,51.041,49.045,49.027,55]pentapentaconta-3,12,15,31,39,42-hexaene-5,21,23,30,35,48,50,53-octone
• 化学式: C₆₆H₈₀N₂O₁₇
• 分子量: 1173.3
• InChiKey: NBIIWMBBABADKB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  85
• 可旋转键数：
  4
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  310
• 氢给体数：
  8
• 氢受体数：
  17