16,39-Dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide, 33-[[3,6-dideoxy-3-[[3-(dimethylamino)-1-oxopropyl]amino]-beta-D-mannopyranosyl]oxy]-1,3,5,7,9,13,37-heptahydroxy-17-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxohexyl]-18-methyl-11,15-dioxo-N-[2-(2-pyridinyl)ethyl]-, (19E,21E,23Z,25Z,27E,29E,31E)-

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 大环内酯类和类似物
• 英文名称: 16,39-Dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide, 33-[[3,6-dideoxy-3-[[3-(dimethylamino)-1-oxopropyl]amino]-beta-D-mannopyranosyl]oxy]-1,3,5,7,9,13,37-heptahydroxy-17-[4-hydroxy-1-methyl-6-[4-(methylamino)phenyl]-6-oxohexyl]-18-methyl-11,15-dioxo-N-[2-(2-pyridinyl)ethyl]-, (19E,21E,23Z,25Z,27E,29E,31E)-
• 英文别名: (19E,21E,23Z,25Z,27E,29E,31E)-33-[(2R,3S,4S,5S,6R)-4-[3-(dimethylamino)propanoylamino]-3,5-dihydroxy-6-methyloxan-2-yl]oxy-1,3,5,7,9,13,37-heptahydroxy-17-[5-hydroxy-7-[4-(methylamino)phenyl]-7-oxoheptan-2-yl]-18-methyl-11,15-dioxo-N-(2-pyridin-2-ylethyl)-16,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxamide
• 化学式: C₇₁H₁₀₃N₅O₁₉
• 分子量: 1330.6
• InChiKey: JBZNXVKOHQWTIF-AVJXEBBESA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  95
• 可旋转键数：
  18
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  377
• 氢给体数：
  13
• 氢受体数：
  22