22-Amino-15,65-dichloro-64-[3,4-dihydroxy-2-(1-hydroxydeca-3,6-dienylideneamino)-5-(hydroxymethyl)cyclohexyl]oxy-2-[4,5-dihydroxy-3-(1-hydroxyethylideneamino)-6-(hydroxymethyl)oxan-2-yl]oxy-21,26,31,35,38,44,49,54,56,59-decahydroxy-47-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-4,6(65),8,10,12(64),14,16,20,23(61),24,26,29(60),30,32,35,38,41(57),42,44,46(51),47,49,53,55,58,62-hexacosaene-52-carboxylic 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: 22-Amino-15,65-dichloro-64-[3,4-dihydroxy-2-(1-hydroxydeca-3,6-dienylideneamino)-5-(hydroxymethyl)cyclohexyl]oxy-2-[4,5-dihydroxy-3-(1-hydroxyethylideneamino)-6-(hydroxymethyl)oxan-2-yl]oxy-21,26,31,35,38,44,49,54,56,59-decahydroxy-47-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-4,6(65),8,10,12(64),14,16,20,23(61),24,26,29(60),30,32,35,38,41(57),42,44,46(51),47,49,53,55,58,62-hexacosaene-52-carboxylic acid
• 英文别名: 22-amino-15,65-dichloro-64-[3,4-dihydroxy-2-(1-hydroxydeca-3,6-dienylideneamino)-5-(hydroxymethyl)cyclohexyl]oxy-2-[4,5-dihydroxy-3-(1-hydroxyethylideneamino)-6-(hydroxymethyl)oxan-2-yl]oxy-21,26,31,35,38,44,49,54,56,59-decahydroxy-47-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,28-trioxa-20,36,39,53,55,58-hexazaundecacyclo[38.14.2.23,6.214,17.219,34.18,12.123,27.129,33.141,45.010,37.046,51]hexahexaconta-4,6(65),8,10,12(64),14,16,20,23(61),24,26,29(60),30,32,35,38,41(57),42,44,46(51),47,49,53,55,58,62-hexacosaene-52-carboxylic acid
• 化学式: C₈₉H₉₇Cl₂N₉O₃₂
• 分子量: 1875.7
• InChiKey: OUUXLGIGCKURDW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  132
• 可旋转键数：
  18
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  681
• 氢给体数：
  24
• 氢受体数：
  41