13-Cyclopentyl-3,8,9,20-tetrahydroxy-57-(hydroxymethyl)-60-(methylamino)-64-oxo-25,63-dioxaheptadecacyclo[59.6.1.14,50.130,34.135,39.141,45.147,50.03,8.04,67.07,21.010,20.012,17.019,24.023,28.023,31.053,58.062,66]triheptaconta-15,26,35,37,39(72),41(71),42,44,53(58),54,56,65-dodecaen-51-yne-21-carbaldehyde

• 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: 13-Cyclopentyl-3,8,9,20-tetrahydroxy-57-(hydroxymethyl)-60-(methylamino)-64-oxo-25,63-dioxaheptadecacyclo[59.6.1.14,50.130,34.135,39.141,45.147,50.03,8.04,67.07,21.010,20.012,17.019,24.023,28.023,31.053,58.062,66]triheptaconta-15,26,35,37,39(72),41(71),42,44,53(58),54,56,65-dodecaen-51-yne-21-carbaldehyde
• 英文别名: 13-cyclopentyl-3,8,9,20-tetrahydroxy-57-(hydroxymethyl)-60-(methylamino)-64-oxo-25,63-dioxaheptadecacyclo[59.6.1.14,50.130,34.135,39.141,45.147,50.03,8.04,67.07,21.010,20.012,17.019,24.023,28.023,31.053,58.062,66]triheptaconta-15,26,35,37,39(72),41(71),42,44,53(58),54,56,65-dodecaen-51-yne-21-carbaldehyde
• 化学式: C₇₉H₉₃NO₉
• 分子量: 1200.6
• InChiKey: OMLNXOXSFIHQHP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.3
• 重原子数：
  89
• 可旋转键数：
  4
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.65
• 拓扑面积：
  166
• 氢给体数：
  6
• 氢受体数：
  10