(-)-(3R,4S,5S,6R,8R,9R,14R)-9-O-tert-butyldimethylsilyl-5-[4-O-(4-O-butyryl-2,6-dideoxy-3-C-methyl-3-O-propionyl-α-L-ribo-hexopyranosyl)-3,6-dideoxy-3-dimethylamino-β-D-glucopyranosyl]-6-(2,2-dimethoxyethyl)-3-hydroxy-4-methoxy-8-methyl-11-(4-phenylbutyl)-11-aza-pentadecan-14-olide | 594873-10-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (-)-(3R,4S,5S,6R,8R,9R,14R)-9-O-tert-butyldimethylsilyl-5-[4-O-(4-O-butyryl-2,6-dideoxy-3-C-methyl-3-O-propionyl-α-L-ribo-hexopyranosyl)-3,6-dideoxy-3-dimethylamino-β-D-glucopyranosyl]-6-(2,2-dimethoxyethyl)-3-hydroxy-4-methoxy-8-methyl-11-(4-phenylbutyl)-11-aza-pentadecan-14-olide
• 英文别名: [(2S,3S,4R,6S)-6-[(2R,3S,4R,5R,6S)-6-[[(2R,7R,8R,10R,11S,12S,13R)-7-[tert-butyl(dimethyl)silyl]oxy-10-(2,2-dimethoxyethyl)-13-hydroxy-12-methoxy-2,8-dimethyl-15-oxo-5-(4-phenylbutyl)-1-oxa-5-azacyclopentadec-11-yl]oxy]-4-(dimethylamino)-5-hydroxy-2-methyloxan-3-yl]oxy-2,4-dimethyl-4-propanoyloxyoxan-3-yl] butanoate
• CAS: 594873-10-6
• 化学式: C₅₈H₁₀₂N₂O₁₆Si
• 分子量: 1111.54
• InChiKey: PSPGULPXHJBAKO-JZYMJMTBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.82
• 重原子数：
  77
• 可旋转键数：
  25
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  200
• 氢给体数：
  2
• 氢受体数：
  18