2-[2',7-Dihydroxy-3'-[1-(2-hydroxyethoxy)-6-[9-hydroxy-11-(2-methoxyethyl)-11-methyl-10-azatricyclo[11.3.1.14,8]octadeca-1(17),8(18),13,15-tetraen-3-yl]hepta-2,4,6-trien-2-yl]-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-[2',7-Dihydroxy-3'-[1-(2-hydroxyethoxy)-6-[9-hydroxy-11-(2-methoxyethyl)-11-methyl-10-azatricyclo[11.3.1.14,8]octadeca-1(17),8(18),13,15-tetraen-3-yl]hepta-2,4,6-trien-2-yl]-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-[2',7-dihydroxy-3'-[1-(2-hydroxyethoxy)-6-[9-hydroxy-11-(2-methoxyethyl)-11-methyl-10-azatricyclo[11.3.1.14,8]octadeca-1(17),8(18),13,15-tetraen-3-yl]hepta-2,4,6-trien-2-yl]-4-(2-hydroxyethyl)-7-[2-(methylamino)ethyl]spiro[bicyclo[3.3.1]non-2-ene-6,1'-cyclopentane]-9-ylidene]propanal
• 化学式: C₅₁H₇₄N₂O₈
• 分子量: 843.1
• InChiKey: AICVCWYERNUPLV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  61
• 可旋转键数：
  17
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  161
• 氢给体数：
  7
• 氢受体数：
  10