4,17,36,49-Tetrahydroxy-25,57-bis(1-hydroxyethyl)-22,54-bis(2-methylpropyl)-9,12,41,44-tetra(propan-2-yl)-11,43-dioxa-8,14,15,21,24,27,29,40,46,47,53,56,59,61-tetradecazadecacyclo[31.31.0.03,62.04,60.06,59.014,19.027,38.028,36.030,35.046,51]tetrahexaconta-1,3(62),30(35),31,33,63-hexaene-7,10,13,20,23,26,39,42,45,52,55,58-dodecone

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: 4,17,36,49-Tetrahydroxy-25,57-bis(1-hydroxyethyl)-22,54-bis(2-methylpropyl)-9,12,41,44-tetra(propan-2-yl)-11,43-dioxa-8,14,15,21,24,27,29,40,46,47,53,56,59,61-tetradecazadecacyclo[31.31.0.03,62.04,60.06,59.014,19.027,38.028,36.030,35.046,51]tetrahexaconta-1,3(62),30(35),31,33,63-hexaene-7,10,13,20,23,26,39,42,45,52,55,58-dodecone
• 英文别名: 4,17,36,49-tetrahydroxy-25,57-bis(1-hydroxyethyl)-22,54-bis(2-methylpropyl)-9,12,41,44-tetra(propan-2-yl)-11,43-dioxa-8,14,15,21,24,27,29,40,46,47,53,56,59,61-tetradecazadecacyclo[31.31.0.03,62.04,60.06,59.014,19.027,38.028,36.030,35.046,51]tetrahexaconta-1,3(62),30(35),31,33,63-hexaene-7,10,13,20,23,26,39,42,45,52,55,58-dodecone
• 化学式: C₇₂H₁₀₄N₁₄O₂₀
• 分子量: 1485.7
• InChiKey: IABLMQAUWMVYCY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.65
• 重原子数：
  106.0
• 可旋转键数：
  10.0
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  498.88
• 氢给体数：
  16.0
• 氢受体数：
  24.0