2-[3'-[1-(2,3-Dihydroxypropoxy)-6-[3-[3-(2-hydroxypropylamino)cyclohexyl]-3-(2-methoxyethyl)-6-methylspiro[4-azabicyclo[9.3.1]pentadeca-1(15),6,11,13-tetraene-10,1'-cyclohexane]-9-yl]hepta-2,4,6-trien-2-yl]-2',7-dihydroxy-4-(2-hydroxyethyl)-7-[2-(methylamino)ethyl]spiro[bicyclo[3.3.1]non-2-ene-6,1'-cyclopentane]-9-ylidene]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: 2-[3'-[1-(2,3-Dihydroxypropoxy)-6-[3-[3-(2-hydroxypropylamino)cyclohexyl]-3-(2-methoxyethyl)-6-methylspiro[4-azabicyclo[9.3.1]pentadeca-1(15),6,11,13-tetraene-10,1'-cyclohexane]-9-yl]hepta-2,4,6-trien-2-yl]-2',7-dihydroxy-4-(2-hydroxyethyl)-7-[2-(methylamino)ethyl]spiro[bicyclo[3.3.1]non-2-ene-6,1'-cyclopentane]-9-ylidene]propanal
• 英文别名: 2-[3'-[1-(2,3-dihydroxypropoxy)-6-[3-[3-(2-hydroxypropylamino)cyclohexyl]-3-(2-methoxyethyl)-6-methylspiro[4-azabicyclo[9.3.1]pentadeca-1(15),6,11,13-tetraene-10,1'-cyclohexane]-9-yl]hepta-2,4,6-trien-2-yl]-2',7-dihydroxy-4-(2-hydroxyethyl)-7-[2-(methylamino)ethyl]spiro[bicyclo[3.3.1]non-2-ene-6,1'-cyclopentane]-9-ylidene]propanal
• 化学式: C₆₃H₉₇N₃O₉
• 分子量: 1040.5
• InChiKey: AKULNXVBZDUIQT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.1
• 重原子数：
  75
• 可旋转键数：
  22
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  193
• 氢给体数：
  9
• 氢受体数：
  12