[6,9,12,15-Tetrahydroxy-10-(6-hydroxy-1,9-dioxonona-2,4,7-trien-4-yl)-3,18-dioxo-13-(3-oxoprop-1-enyl)-7-[4,10,13-trihydroxy-7-[2-hydroxy-3-(2-hydroxyethylidene)-6-oxohex-4-enylidene]-1,16-dioxo-6,11-bis(3-oxoprop-1-enyl)hexadeca-2,5,8,11,14-pentaen-8-yl]octadeca-4,7,10,13,16-pentaen-1-ynyl] 2-methylbutanoate

• 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: [6,9,12,15-Tetrahydroxy-10-(6-hydroxy-1,9-dioxonona-2,4,7-trien-4-yl)-3,18-dioxo-13-(3-oxoprop-1-enyl)-7-[4,10,13-trihydroxy-7-[2-hydroxy-3-(2-hydroxyethylidene)-6-oxohex-4-enylidene]-1,16-dioxo-6,11-bis(3-oxoprop-1-enyl)hexadeca-2,5,8,11,14-pentaen-8-yl]octadeca-4,7,10,13,16-pentaen-1-ynyl] 2-methylbutanoate
• 英文别名: [6,9,12,15-tetrahydroxy-10-(6-hydroxy-1,9-dioxonona-2,4,7-trien-4-yl)-3,18-dioxo-13-(3-oxoprop-1-enyl)-7-[4,10,13-trihydroxy-7-[2-hydroxy-3-(2-hydroxyethylidene)-6-oxohex-4-enylidene]-1,16-dioxo-6,11-bis(3-oxoprop-1-enyl)hexadeca-2,5,8,11,14-pentaen-8-yl]octadeca-4,7,10,13,16-pentaen-1-ynyl] 2-methylbutanoate
• 化学式: C₆₅H₆₈O₂₂
• 分子量: 1201.2
• InChiKey: RESZMWJUSNNUTL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  87
• 可旋转键数：
  42
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  399
• 氢给体数：
  10
• 氢受体数：
  22