(1R,17S)-9t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-7t-(3,O³-dimethyl-α-L-ribo-2,6-dideoxy-hexopyranosyloxy)-3t-ethyl-2c,10c-dihydroxy-2t,6c,8c,10t,12t,17-hexamethyl-15ξ-phenoxymethyl-(1rH,13tH)-4,16-dioxa-14-aza-bicyclo[11.3.1]heptadecan-5-one | 62005-62-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (1R,17S)-9t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-7t-(3,O³-dimethyl-α-L-ribo-2,6-dideoxy-hexopyranosyloxy)-3t-ethyl-2c,10c-dihydroxy-2t,6c,8c,10t,12t,17-hexamethyl-15ξ-phenoxymethyl-(1rH,13tH)-4,16-dioxa-14-aza-bicyclo[11.3.1]heptadecan-5-one
• 英文别名: (9S)-9-amino-N⁹,O¹¹-((Ξ)-2-phenoxy-ethane-1,1-diyl)-9-deoxo-erythromycin
• CAS: 62005-62-3
• 化学式: C₄₅H₇₆N₂O₁₃
• 分子量: 853.104
• InChiKey: PQXWLDJWTJEPGC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.62
• 重原子数：
  60.0
• 可旋转键数：
  10.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.84
• 拓扑面积：
  187.1
• 氢给体数：
  5.0
• 氢受体数：
  15.0