26-(1-Cyclopentylethyl)-21,22,23,30,68-pentahydroxy-8-(hydroxymethyl)-11-(methylamino)-15-oxo-14-oxahexadecacyclo[31.27.3.11,58.112,19.129,41.131,41.146,50.152,56.04,9.013,17.018,62.021,62.022,32.024,30.037,45.038,42]nonahexaconta-4(9),5,7,16,46,48,50(66),52(65),53,55-decaen-2,34-diyne-31-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: 26-(1-Cyclopentylethyl)-21,22,23,30,68-pentahydroxy-8-(hydroxymethyl)-11-(methylamino)-15-oxo-14-oxahexadecacyclo[31.27.3.11,58.112,19.129,41.131,41.146,50.152,56.04,9.013,17.018,62.021,62.022,32.024,30.037,45.038,42]nonahexaconta-4(9),5,7,16,46,48,50(66),52(65),53,55-decaen-2,34-diyne-31-carbaldehyde
• 英文别名: 26-(1-cyclopentylethyl)-21,22,23,30,68-pentahydroxy-8-(hydroxymethyl)-11-(methylamino)-15-oxo-14-oxahexadecacyclo[31.27.3.11,58.112,19.129,41.131,41.146,50.152,56.04,9.013,17.018,62.021,62.022,32.024,30.037,45.038,42]nonahexaconta-4(9),5,7,16,46,48,50(66),52(65),53,55-decaen-2,34-diyne-31-carbaldehyde
• 化学式: C₇₈H₉₃NO₉
• 分子量: 1188.6
• InChiKey: UWVXMIBDOHHKPR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.7
• 重原子数：
  88
• 可旋转键数：
  5
• 环数：
  18.0
• 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