41-[4-Hydroxy-1-(hydroxymethoxy)butan-2-yl]-42-(hydroxymethyl)-71-(1-hydroxypropan-2-ylidene)-48-methyl-35,39,47,73-tetraoxaoctadecacyclo[34.33.5.39,15.24,7.12,63.128,32.022,27.031,66.037,46.038,43.048,74.049,61.051,60.052,57.064,69.012,78.019,77.023,77]henoctaconta-4(81),5,7(80),9(79),10,12(78),13,22(27),23,25,29,37(46),38(43),41,44,52,54,56,58,64(69),65,67-docosaene-34,40,72-trione

• 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: 41-[4-Hydroxy-1-(hydroxymethoxy)butan-2-yl]-42-(hydroxymethyl)-71-(1-hydroxypropan-2-ylidene)-48-methyl-35,39,47,73-tetraoxaoctadecacyclo[34.33.5.39,15.24,7.12,63.128,32.022,27.031,66.037,46.038,43.048,74.049,61.051,60.052,57.064,69.012,78.019,77.023,77]henoctaconta-4(81),5,7(80),9(79),10,12(78),13,22(27),23,25,29,37(46),38(43),41,44,52,54,56,58,64(69),65,67-docosaene-34,40,72-trione
• 英文别名: 41-[4-hydroxy-1-(hydroxymethoxy)butan-2-yl]-42-(hydroxymethyl)-71-(1-hydroxypropan-2-ylidene)-48-methyl-35,39,47,73-tetraoxaoctadecacyclo[34.33.5.39,15.24,7.12,63.128,32.022,27.031,66.037,46.038,43.048,74.049,61.051,60.052,57.064,69.012,78.019,77.023,77]henoctaconta-4(81),5,7(80),9(79),10,12(78),13,22(27),23,25,29,37(46),38(43),41,44,52,54,56,58,64(69),65,67-docosaene-34,40,72-trione
• 化学式: C₈₇H₈₈O₁₂
• 分子量: 1325.6
• InChiKey: GQRBEIQROKTZNJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.8
• 重原子数：
  99
• 可旋转键数：
  8
• 环数：
  22.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  178
• 氢给体数：
  4
• 氢受体数：
  12