2-[[13,21-Dihydroxy-31-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-7-(10-oxahexacyclo[17.3.1.04,9.09,22.012,21.015,20]tricosa-15(20),16,18-trien-21-yl)-11,24,41-trioxa-2,43,45-triazadecacyclo[23.20.1.12,5.116,20.04,9.012,17.023,28.034,46.035,44.037,42]octatetraconta-1(46),3,5(48),6,8,12,14,16,18,26,34-undecaen-32-yn-26-yl]methyl]-1-(3-methoxypropyl)guanidine

• 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: 2-[[13,21-Dihydroxy-31-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-7-(10-oxahexacyclo[17.3.1.04,9.09,22.012,21.015,20]tricosa-15(20),16,18-trien-21-yl)-11,24,41-trioxa-2,43,45-triazadecacyclo[23.20.1.12,5.116,20.04,9.012,17.023,28.034,46.035,44.037,42]octatetraconta-1(46),3,5(48),6,8,12,14,16,18,26,34-undecaen-32-yn-26-yl]methyl]-1-(3-methoxypropyl)guanidine
• 英文别名: 2-[[13,21-dihydroxy-31-[2-[4-hydroxy-3-[(3-hydroxyphenyl)methyl]phenyl]ethyl]-15-(hydroxymethyl)-7-(10-oxahexacyclo[17.3.1.04,9.09,22.012,21.015,20]tricosa-15(20),16,18-trien-21-yl)-11,24,41-trioxa-2,43,45-triazadecacyclo[23.20.1.12,5.116,20.04,9.012,17.023,28.034,46.035,44.037,42]octatetraconta-1(46),3,5(48),6,8,12,14,16,18,26,34-undecaen-32-yn-26-yl]methyl]-1-(3-methoxypropyl)guanidine
• 化学式: C₈₆H₉₈N₆O₁₀
• 分子量: 1375.7
• InChiKey: APKIONOGIOGTIU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.3
• 重原子数：
  102
• 可旋转键数：
  14
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  227
• 氢给体数：
  9
• 氢受体数：
  13