33'-Cyclopentyl-27',28',29',40',43'-pentahydroxy-14'-(hydroxymethyl)-17'-(methylamino)-21'-oxo-6-phenylspiro[1,2,3a,4,5,6,7,7a-octahydroindene-3,41'-20-oxadecacyclo[28.12.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,43]tetratetraconta-10(15),11,13,22,35-pentaen-8-yne]-1'-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: 33'-Cyclopentyl-27',28',29',40',43'-pentahydroxy-14'-(hydroxymethyl)-17'-(methylamino)-21'-oxo-6-phenylspiro[1,2,3a,4,5,6,7,7a-octahydroindene-3,41'-20-oxadecacyclo[28.12.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,43]tetratetraconta-10(15),11,13,22,35-pentaen-8-yne]-1'-carbaldehyde
• 英文别名: 33'-cyclopentyl-27',28',29',40',43'-pentahydroxy-14'-(hydroxymethyl)-17'-(methylamino)-21'-oxo-6-phenylspiro[1,2,3a,4,5,6,7,7a-octahydroindene-3,41'-20-oxadecacyclo[28.12.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,43]tetratetraconta-10(15),11,13,22,35-pentaen-8-yne]-1'-carbaldehyde
• 化学式: C₆₅H₈₁NO₉
• 分子量: 1020.3
• InChiKey: WPSSNNAYGWUPOP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  75
• 可旋转键数：
  5
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  177
• 氢给体数：
  7
• 氢受体数：
  10