55,56,57,59-Tetrahydroxy-42-(hydroxymethyl)-9-methyl-45-(methylamino)-49-oxo-26-phenyl-48,63-dioxa-15,16-dithiapentadecacyclo[29.28.1.14,18.18,58.110,13.146,53.03,20.03,23.05,59.022,27.033,52.033,55.038,43.047,51.056,60]tetrahexaconta-38(43),39,41,50-tetraen-29,36-diyne-1-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: 55,56,57,59-Tetrahydroxy-42-(hydroxymethyl)-9-methyl-45-(methylamino)-49-oxo-26-phenyl-48,63-dioxa-15,16-dithiapentadecacyclo[29.28.1.14,18.18,58.110,13.146,53.03,20.03,23.05,59.022,27.033,52.033,55.038,43.047,51.056,60]tetrahexaconta-38(43),39,41,50-tetraen-29,36-diyne-1-carbaldehyde
• 英文别名: 55,56,57,59-tetrahydroxy-42-(hydroxymethyl)-9-methyl-45-(methylamino)-49-oxo-26-phenyl-48,63-dioxa-15,16-dithiapentadecacyclo[29.28.1.14,18.18,58.110,13.146,53.03,20.03,23.05,59.022,27.033,52.033,55.038,43.047,51.056,60]tetrahexaconta-38(43),39,41,50-tetraen-29,36-diyne-1-carbaldehyde
• 化学式: C₇₀H₈₅NO₉S₂
• 分子量: 1148.6
• InChiKey: GYMLNCQZGFVSNG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.7
• 重原子数：
  82
• 可旋转键数：
  4
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  216
• 氢给体数：
  6
• 氢受体数：
  12