5-[[1-[[Carboxy(hydroxy)methyl]amino]-1-oxo-3-[22-oxo-3-(pyridin-4-ylmethyl)spiro[23-oxa-6-azaoctacyclo[23.6.2.29,13.11,21.04,21.05,10.012,17.024,34]hexatriaconta-3,12(17),13,15,24(34),32,35-heptaen-19-yne-26,1'-cyclopentane]-25-yl]sulfanylpropan-2-yl]amino]-2-hydroxy-2-(methylaminomethylamino)-5-oxopentanoic 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: 5-[[1-[[Carboxy(hydroxy)methyl]amino]-1-oxo-3-[22-oxo-3-(pyridin-4-ylmethyl)spiro[23-oxa-6-azaoctacyclo[23.6.2.29,13.11,21.04,21.05,10.012,17.024,34]hexatriaconta-3,12(17),13,15,24(34),32,35-heptaen-19-yne-26,1'-cyclopentane]-25-yl]sulfanylpropan-2-yl]amino]-2-hydroxy-2-(methylaminomethylamino)-5-oxopentanoic acid
• 英文别名: 5-[[1-[[carboxy(hydroxy)methyl]amino]-1-oxo-3-[22-oxo-3-(pyridin-4-ylmethyl)spiro[23-oxa-6-azaoctacyclo[23.6.2.29,13.11,21.04,21.05,10.012,17.024,34]hexatriaconta-3,12(17),13,15,24(34),32,35-heptaen-19-yne-26,1'-cyclopentane]-25-yl]sulfanylpropan-2-yl]amino]-2-hydroxy-2-(methylaminomethylamino)-5-oxopentanoic acid
• 化学式: C₅₆H₆₆N₆O₁₀S
• 分子量: 1015.2
• InChiKey: QIRWAFWLKPOVFO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.3
• 重原子数：
  73
• 可旋转键数：
  16
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  274
• 氢给体数：
  9
• 氢受体数：
  15