[14-[9-[3-[2-[4-[[4-(Dimethylamino)-2,3-dihydroxy-5-methoxypentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-7-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxy-4,4,8-trimethyl-1,10-dioxaspiro[4.5]decan-2-yl]-10,12-dihydroxy-14-methoxy-2,6,7,9,11-pentamethyltetradeca-1,3,5,7-tetraenyl]-methanidylazanium

• 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: [14-[9-[3-[2-[4-[[4-(Dimethylamino)-2,3-dihydroxy-5-methoxypentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-7-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxy-4,4,8-trimethyl-1,10-dioxaspiro[4.5]decan-2-yl]-10,12-dihydroxy-14-methoxy-2,6,7,9,11-pentamethyltetradeca-1,3,5,7-tetraenyl]-methanidylazanium
• 英文别名: [14-[9-[3-[2-[4-[[4-(dimethylamino)-2,3-dihydroxy-5-methoxypentanoyl]amino]butan-2-yl]-1,3-oxazol-4-yl]prop-2-enyl]-7-hydroxy-3-[hydroxy(phosphonooxy)phosphoryl]oxy-4,4,8-trimethyl-1,10-dioxaspiro[4.5]decan-2-yl]-10,12-dihydroxy-14-methoxy-2,6,7,9,11-pentamethyltetradeca-1,3,5,7-tetraenyl]-methanidylazanium
• 化学式: C50H86N4O18P2
• 分子量: 1093.2
• InChiKey: MVVORQJQTZVXAN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.3
• 重原子数：
  74
• 可旋转键数：
  29
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  326
• 氢给体数：
  10
• 氢受体数：
  21