[8-Amino-53-(dihydroxymethyl)-2,51,59-trihydroxy-49-oxa-37,38-dithia-7,9,45,69-tetrazahexadecacyclo[40.19.4.339,44.213,33.144,48.150,54.01,6.010,15.010,36.011,30.011,33.012,27.014,22.014,25.018,22.056,64]doheptaconta-4,7,16,26,50,52,54(66),71-octaen-40,62-diyn-57-yl] acetate

• 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: [8-Amino-53-(dihydroxymethyl)-2,51,59-trihydroxy-49-oxa-37,38-dithia-7,9,45,69-tetrazahexadecacyclo[40.19.4.339,44.213,33.144,48.150,54.01,6.010,15.010,36.011,30.011,33.012,27.014,22.014,25.018,22.056,64]doheptaconta-4,7,16,26,50,52,54(66),71-octaen-40,62-diyn-57-yl] acetate
• 英文别名: [8-amino-53-(dihydroxymethyl)-2,51,59-trihydroxy-49-oxa-37,38-dithia-7,9,45,69-tetrazahexadecacyclo[40.19.4.339,44.213,33.144,48.150,54.01,6.010,15.010,36.011,30.011,33.012,27.014,22.014,25.018,22.056,64]doheptaconta-4,7,16,26,50,52,54(66),71-octaen-40,62-diyn-57-yl] acetate
• 化学式: C₆₈H₈₅N₅O₈S₂
• 分子量: 1164.6
• InChiKey: BZDFQQJCQJNOJF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.4
• 重原子数：
  83
• 可旋转键数：
  3
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  262
• 氢给体数：
  9
• 氢受体数：
  13