28-(Dihydroxymethyl)-9,16,33,49,59,72-hexahydroxy-29-[(3-hydroxyphenyl)methyl]-15-methoxy-53-methyl-38,40,51,56-tetrazatridecacyclo[33.24.10.341,47.26,19.12,7.126,30.154,57.162,65.04,34.013,18.020,25.039,69.044,73]octaheptaconta-13,15,17,20,22,24,35,39(69),41(74),42,44(73),45,47(72),54,57(71)-pentadecaen-31,67,76-triyne-8,10-dione

• 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: 28-(Dihydroxymethyl)-9,16,33,49,59,72-hexahydroxy-29-[(3-hydroxyphenyl)methyl]-15-methoxy-53-methyl-38,40,51,56-tetrazatridecacyclo[33.24.10.341,47.26,19.12,7.126,30.154,57.162,65.04,34.013,18.020,25.039,69.044,73]octaheptaconta-13,15,17,20,22,24,35,39(69),41(74),42,44(73),45,47(72),54,57(71)-pentadecaen-31,67,76-triyne-8,10-dione
• 英文别名: 28-(dihydroxymethyl)-9,16,33,49,59,72-hexahydroxy-29-[(3-hydroxyphenyl)methyl]-15-methoxy-53-methyl-38,40,51,56-tetrazatridecacyclo[33.24.10.341,47.26,19.12,7.126,30.154,57.162,65.04,34.013,18.020,25.039,69.044,73]octaheptaconta-13,15,17,20,22,24,35,39(69),41(74),42,44(73),45,47(72),54,57(71)-pentadecaen-31,67,76-triyne-8,10-dione
• 化学式: C₈₄H₉₄N₄O₁₂
• 分子量: 1351.7
• InChiKey: DKDBBDVLAYCGPH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.6
• 重原子数：
  100
• 可旋转键数：
  4
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.48
• 拓扑面积：
  277
• 氢给体数：
  13
• 氢受体数：
  15