3-[4-(3-Aminopropyl)-43'-hydroxy-28'-methyl-3,46'-dioxo-41'-trispiro[4.0.0.47.36.35]heptadecan-13-ylspiro[2-benzofuran-1,5'-45-oxa-34,40-diazatridecacyclo[28.18.2.19,13.113,16.136,40.04,44.04,47.06,47.08,23.025,48.027,49.033,38.034,50]tripentaconta-1(48),23,30(50),43-tetraene]-19'-yl]propanal

• 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: 3-[4-(3-Aminopropyl)-43'-hydroxy-28'-methyl-3,46'-dioxo-41'-trispiro[4.0.0.47.36.35]heptadecan-13-ylspiro[2-benzofuran-1,5'-45-oxa-34,40-diazatridecacyclo[28.18.2.19,13.113,16.136,40.04,44.04,47.06,47.08,23.025,48.027,49.033,38.034,50]tripentaconta-1(48),23,30(50),43-tetraene]-19'-yl]propanal
• 英文别名: 3-[4-(3-aminopropyl)-43'-hydroxy-28'-methyl-3,46'-dioxo-41'-trispiro[4.0.0.47.36.35]heptadecan-13-ylspiro[2-benzofuran-1,5'-45-oxa-34,40-diazatridecacyclo[28.18.2.19,13.113,16.136,40.04,44.04,47.06,47.08,23.025,48.027,49.033,38.034,50]tripentaconta-1(48),23,30(50),43-tetraene]-19'-yl]propanal
• 化学式: C₈₁H₁₀₉N₃O₆
• 分子量: 1220.7
• InChiKey: KGTNIJHERQIORO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.4
• 重原子数：
  90
• 可旋转键数：
  7
• 环数：
  22.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  122
• 氢给体数：
  2
• 氢受体数：
  9