10-Cyclopentyl-5,6,17,61,68-pentahydroxy-48-(hydroxymethyl)-51-(methylamino)-55-oxospiro[54-oxapentadecacyclo[39.20.1.116,20.120,23.126,30.132,36.138,41.152,59.01,58.04,18.05,61.07,17.09,14.044,49.053,57]octahexaconta-12,26(66),27,29,32,34,36(65),44(49),45,47,56-undecaen-42-yne-31,1'-cyclopentane]-18-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: 10-Cyclopentyl-5,6,17,61,68-pentahydroxy-48-(hydroxymethyl)-51-(methylamino)-55-oxospiro[54-oxapentadecacyclo[39.20.1.116,20.120,23.126,30.132,36.138,41.152,59.01,58.04,18.05,61.07,17.09,14.044,49.053,57]octahexaconta-12,26(66),27,29,32,34,36(65),44(49),45,47,56-undecaen-42-yne-31,1'-cyclopentane]-18-carbaldehyde
• 英文别名: 10-cyclopentyl-5,6,17,61,68-pentahydroxy-48-(hydroxymethyl)-51-(methylamino)-55-oxospiro[54-oxapentadecacyclo[39.20.1.116,20.120,23.126,30.132,36.138,41.152,59.01,58.04,18.05,61.07,17.09,14.044,49.053,57]octahexaconta-12,26(66),27,29,32,34,36(65),44(49),45,47,56-undecaen-42-yne-31,1'-cyclopentane]-18-carbaldehyde
• 化学式: C₇₉H₉₇NO₉
• 分子量: 1204.6
• InChiKey: DVNQUHDJKWLIHE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.8
• 重原子数：
  89
• 可旋转键数：
  4
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  177
• 氢给体数：
  7
• 氢受体数：
  10