(3R)-14t-ethyl-6t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-4t,7c,10c,12t-tetrahydroxy-3r,5c,7t,9t,11c,13t-hexamethyl-oxacyclotetradecan-2-one | 119533-85-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (3R)-14t-ethyl-6t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-4t,7c,10c,12t-tetrahydroxy-3r,5c,7t,9t,11c,13t-hexamethyl-oxacyclotetradecan-2-one
• 英文别名: (3R)-14t-ethyl-6t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-4t,7c,10c,12t-tetrahydroxy-3r,5c,7t,9t,11c,13t-hexamethyl-oxacyclotetradecan-2-one；(3R)-14t-Aethyl-6t-(3-dimethylamino-β-D-xylo-3,4,6-tridesoxy-hexopyranosyloxy)-4t,7c,10c,12t-tetrahydroxy-3r,5c,7t,9t,11c,13t-hexamethyl-oxacyclotetradecan-2-on
• CAS: 119533-85-6
• 化学式: C₂₉H₅₅NO₉
• 分子量: 561.757
• InChiKey: ZXPSBYQOGAAQAV-CUZVTCKVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.54
• 重原子数：
  39.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.97
• 拓扑面积：
  149.15
• 氢给体数：
  5.0
• 氢受体数：
  10.0

反应信息

• 作为产物：
  描述：

  红霉素B 在 甲醇 、 硼酸三钠 作用下， 生成 (3R)-14t-ethyl-6t-(3-dimethylamino-β-D-xylo-3,4,6-trideoxy-hexopyranosyloxy)-4t,7c,10c,12t-tetrahydroxy-3r,5c,7t,9t,11c,13t-hexamethyl-oxacyclotetradecan-2-one
  参考文献：
  名称：

  Erythromycin. XI.¹ Structure of Erythromycin B²

  摘要：

  DOI：

  10.1021/ja01579a060