(-)-(3R,4S,5S,6R,8R,14R)-5-[2-O-acetyl-4-O-(3-O-acetyl-2,6-dideoxy-3-C-methyl-4-O-propionyl-α-L-ribo-hexopyranosyl)-3,6-dideoxy-3-dimethylamino-β-D-glucopyranosyl]-6-(2,2-dimethoxyethyl)-4-methoxy-8-methyl-11-(N-methyl-N-(3-phenylpropyl)amino)-3-propionyloxy-11-aza-pentadecan-1 4-olide | 594873-01-5

• 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,14R)-5-[2-O-acetyl-4-O-(3-O-acetyl-2,6-dideoxy-3-C-methyl-4-O-propionyl-α-L-ribo-hexopyranosyl)-3,6-dideoxy-3-dimethylamino-β-D-glucopyranosyl]-6-(2,2-dimethoxyethyl)-4-methoxy-8-methyl-11-(N-methyl-N-(3-phenylpropyl)amino)-3-propionyloxy-11-aza-pentadecan-1 4-olide
• 英文别名: [(2R,8R,10R,11S,12S,13R)-11-[(2S,3R,4S,5S,6R)-3-acetyloxy-5-[(2S,4R,5S,6S)-4-acetyloxy-4,6-dimethyl-5-propanoyloxyoxan-2-yl]oxy-4-(dimethylamino)-6-methyloxan-2-yl]oxy-10-(2,2-dimethoxyethyl)-12-methoxy-2,8-dimethyl-5-[methyl(3-phenylpropyl)amino]-15-oxo-1-oxa-5-azacyclopentadec-13-yl] propanoate
• CAS: 594873-01-5
• 化学式: C₅₅H₉₁N₃O₁₇
• 分子量: 1066.34
• InChiKey: KLKWRSDEOKZNNG-VAFQEPHJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  75
• 可旋转键数：
  25
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  206
• 氢给体数：
  0
• 氢受体数：
  20