33-Cyclopentyl-27,28,50-trihydroxy-14-(hydroxymethyl)-17-(methylamino)-21-oxo-46-(2-phenylethyl)-20,41-dioxadodecacyclo[28.19.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,50.040,48.044,48]henpentaconta-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-27,28,50-trihydroxy-14-(hydroxymethyl)-17-(methylamino)-21-oxo-46-(2-phenylethyl)-20,41-dioxadodecacyclo[28.19.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,50.040,48.044,48]henpentaconta-10(15),11,13,22,35-pentaen-8-yne-1-carbaldehyde
• 英文别名: 33-cyclopentyl-27,28,50-trihydroxy-14-(hydroxymethyl)-17-(methylamino)-21-oxo-46-(2-phenylethyl)-20,41-dioxadodecacyclo[28.19.1.118,25.02,28.05,24.05,27.010,15.019,23.032,37.039,50.040,48.044,48]henpentaconta-10(15),11,13,22,35-pentaen-8-yne-1-carbaldehyde
• 化学式: C₆₅H₈₁NO₈
• 分子量: 1004.3
• InChiKey: GAFAKJRVBNRVCQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.2
• 重原子数：
  74
• 可旋转键数：
  7
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  146
• 氢给体数：
  5
• 氢受体数：
  9