18-[3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-53-amino-5,15-dichloro-64-[4,5-dihydroxy-6-(hydroxymethyl)-3-(9-methyldecanoylamino)oxan-2-yl]oxy-25,30,43,48-tetrahydroxy-20,36,39,54,56,59-hexaoxo-27-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,46-trioxa-21,35,38,55,57,60-hexazaundecacyclo[38.15.2.23,6.214,17.219,34.18,12.129,33.141,45.010,37.023,28.047,52]hexahexaconta-3,5,8(64),9,11,14,16,23(28),24,26,29,31,33(61),41,43,45(58),47(52),48,50,62,65-henicosaene-22-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: 18-[3-Acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-53-amino-5,15-dichloro-64-[4,5-dihydroxy-6-(hydroxymethyl)-3-(9-methyldecanoylamino)oxan-2-yl]oxy-25,30,43,48-tetrahydroxy-20,36,39,54,56,59-hexaoxo-27-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,46-trioxa-21,35,38,55,57,60-hexazaundecacyclo[38.15.2.23,6.214,17.219,34.18,12.129,33.141,45.010,37.023,28.047,52]hexahexaconta-3,5,8(64),9,11,14,16,23(28),24,26,29,31,33(61),41,43,45(58),47(52),48,50,62,65-henicosaene-22-carboxylic acid
• 英文别名: 18-[3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-53-amino-5,15-dichloro-64-[4,5-dihydroxy-6-(hydroxymethyl)-3-(9-methyldecanoylamino)oxan-2-yl]oxy-25,30,43,48-tetrahydroxy-20,36,39,54,56,59-hexaoxo-27-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-7,13,46-trioxa-21,35,38,55,57,60-hexazaundecacyclo[38.15.2.23,6.214,17.219,34.18,12.129,33.141,45.010,37.023,28.047,52]hexahexaconta-3,5,8(64),9,11,14,16,23(28),24,26,29,31,33(61),41,43,45(58),47(52),48,50,62,65-henicosaene-22-carboxylic acid
• 化学式: C₈₉H₉₉Cl₂N₉O₃₃
• 分子量: 1893.7
• InChiKey: LXSXKZOELYZWTQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  133
• 可旋转键数：
  20
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  662
• 氢给体数：
  24
• 氢受体数：
  34