32-(1-Cyclopentylethyl)-27,28,29,36,39-pentahydroxy-17-(hydroxymethylamino)-21-oxo-3'-(2-phenylethyl)spiro[20-oxanonacyclo[28.8.1.118,25.02,28.05,24.05,27.010,15.019,23.035,39]tetraconta-10,12,14,22-tetraen-8-yne-37,1'-cyclopentane]-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: 32-(1-Cyclopentylethyl)-27,28,29,36,39-pentahydroxy-17-(hydroxymethylamino)-21-oxo-3'-(2-phenylethyl)spiro[20-oxanonacyclo[28.8.1.118,25.02,28.05,24.05,27.010,15.019,23.035,39]tetraconta-10,12,14,22-tetraen-8-yne-37,1'-cyclopentane]-1-carbaldehyde
• 英文别名: 32-(1-cyclopentylethyl)-27,28,29,36,39-pentahydroxy-17-(hydroxymethylamino)-21-oxo-3'-(2-phenylethyl)spiro[20-oxanonacyclo[28.8.1.118,25.02,28.05,24.05,27.010,15.019,23.035,39]tetraconta-10,12,14,22-tetraen-8-yne-37,1'-cyclopentane]-1-carbaldehyde
• 化学式: C₆₀H₇₇NO₉
• 分子量: 956.3
• InChiKey: XXLBUSOWIUCAQB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.1
• 重原子数：
  70
• 可旋转键数：
  8
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  177
• 氢给体数：
  7
• 氢受体数：
  10