3-[(4R,5S,6S,9R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-5-methoxy-4,9,16-trimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]propanal;N-[6-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[(4R,5S,6S,7S,9R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-5-methoxy-4,9,16-trimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]propylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-6-oxohexyl]-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-b]pyrrol-6-yl)pentanoylamino]hexanamide

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3-[(4R,5S,6S,9R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-5-methoxy-4,9,16-trimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]propanal;N-[6-[2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[(4R,5S,6S,7S,9R,11E,13E,16R)-6-[5-(4,5-dihydroxy-4,6-dimethyloxan-2-yl)oxy-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-10-[5-(dimethylamino)-6-methyloxan-2-yl]oxy-5-methoxy-4,9,16-trimethyl-2-oxo-1-oxacyclohexadeca-11,13-dien-7-yl]propylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethylamino]-6-oxohexyl]-6-[5-(2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-b]pyrrol-6-yl)pentanoylamino]hexanamide
• 化学式: C131H233N9O37S
• 分子量: 2558.4
• InChiKey: PNEKNTAZHBSCHD-BICPXLNVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.15
• 重原子数：
  178
• 可旋转键数：
  69
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.89
• 拓扑面积：
  561
• 氢给体数：
  11
• 氢受体数：
  43