4-[41-(3-aminopropyl)-14-(3,5-dichloro-4-hydroxyphenyl)-7,10,13,16,19,22,25,28,31,34,37,40,43,46-tetradecahydroxy-26-[3-[(C-hydroxycarbonimidoyl)amino]propyl]-29,38,47-tris(1-hydroxyethyl)-17-(hydroxymethyl)-3,20,32,35,44-pentakis(4-hydroxyphenyl)-8,23-bis[(2-iminoimidazolidin-4-yl)methyl]-5-methyl-2,4-dioxo-1,3,6,9,12,15,18,21,24,27,30,33,36,39,42,45-hexadecazacycloheptatetraconta-6,9,12,15,18,21,24,27,30,33,36,39,42,45-tetradecaen-1-yl]-3-[(1-hydroxy-11-methyldodeca-2,5-dienylidene)amino]-4-oxobutanoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 4-[41-(3-aminopropyl)-14-(3,5-dichloro-4-hydroxyphenyl)-7,10,13,16,19,22,25,28,31,34,37,40,43,46-tetradecahydroxy-26-[3-[(C-hydroxycarbonimidoyl)amino]propyl]-29,38,47-tris(1-hydroxyethyl)-17-(hydroxymethyl)-3,20,32,35,44-pentakis(4-hydroxyphenyl)-8,23-bis[(2-iminoimidazolidin-4-yl)methyl]-5-methyl-2,4-dioxo-1,3,6,9,12,15,18,21,24,27,30,33,36,39,42,45-hexadecazacycloheptatetraconta-6,9,12,15,18,21,24,27,30,33,36,39,42,45-tetradecaen-1-yl]-3-[(1-hydroxy-11-methyldodeca-2,5-dienylidene)amino]-4-oxobutanoic acid
• 化学式: C₁₀₇H₁₃₈Cl₂N₂₆O₃₁
• 分子量: 2355.3
• InChiKey: MXPOVPVMDCYJPO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  166
• 可旋转键数：
  34
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  964
• 氢给体数：
  36
• 氢受体数：
  50