three disacharide linked murein units (tetrapeptide crosslinked tetrapeptide (A2pm->D-ala) and tetrapeptide corsslinked tetrapeptide (A2pm->D-ala)) (middle of chain)

• 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: three disacharide linked murein units (tetrapeptide crosslinked tetrapeptide (A2pm->D-ala) and tetrapeptide corsslinked tetrapeptide (A2pm->D-ala)) (middle of chain)
• 英文别名: 58,69,82,83,85-pentaacetamido-26-(4-azaniumyl-4-carboxylatobutyl)-23,49,78-tris(2-carboxylatoethyl)-46-(1-carboxylatoethylcarbamoyl)-14-[4,5-dihydroxy-6-(hydroxymethyl)-3-(1-oxoniumylideneethylazanidyl)oxan-2-yl]oxy-81,84-dihydroxy-3,8,13,61,66-pentakis(hydroxymethyl)-17,20,29,39,52,55,72,75-octamethyl-18,21,24,27,30,37,40,48,51,54,73,76,79-tridecaoxo-2,5,7,10,12,16,56,60,63,65,68,71-dodecaoxa-19,22,25,28,31,38,41,47,50,53,74,77,80-tridecazaheptacyclo[34.32.12.26,9.264,67.111,15.04,70.057,62]pentaoctacont-58-ene-32,42-dicarboxylate
• 化学式: C111H167N21O58-6
• 分子量: 2723.6
• InChiKey: UTRNZNRTDGDGJL-UHFFFAOYSA-H

计算性质

• 辛醇/水分配系数(LogP)：
  -13.9
• 重原子数：
  190
• 可旋转键数：
  26
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.74
• 拓扑面积：
  1200
• 氢给体数：
  31
• 氢受体数：
  58