3',9'-bis-N-desmethyl azithromycin | 620169-48-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 3',9'-bis-N-desmethyl azithromycin
• 英文别名: 3'-N-demethyl-9-deoxo-9a-aza-9a-homoerythromycin A；3'-N-Desmethyl-9a-N-desmethylazithromycin；(2R,3S,4R,5R,8R,10R,11R,12S,13S,14R)-2-ethyl-3,4,10-trihydroxy-13-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-11-[(2S,3R,4S,6R)-3-hydroxy-6-methyl-4-(methylamino)oxan-2-yl]oxy-3,5,8,10,12,14-hexamethyl-1-oxa-6-azacyclopentadecan-15-one
• CAS: 620169-48-4
• 化学式: C₃₆H₆₈N₂O₁₂
• 分子量: 720.942
• InChiKey: IEZJOWXSXAYUIB-GGNUPITBSA-N

物化性质

• 沸点：
  814.6±65.0 °C(Predicted)
• 密度：
  1.19±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.1
• 重原子数：
  50
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.97
• 拓扑面积：
  198
• 氢给体数：
  7
• 氢受体数：
  14

反应信息

• 作为反应物：
  描述：

  3',9'-bis-N-desmethyl azithromycin 在 N,N-二异丙基乙胺 作用下， 以 N,N-二甲基甲酰胺 、 乙腈 为溶剂， 反应 24.75h， 生成 2'-O,3'-N-(carbonimidoyl)-3'-N-demethyl-N'-isopropyl-9-deoxo-9a-aza-9a-(2-propyn-1-yl)-9a-homoerythromycin A
  参考文献：
  名称：

  [EN] 2'-O,3'-N-BRIDGED MACROLIDES
  [FR] MACROLIDES 2'-O,3'-N-PONTÉS

  摘要：

  ' -O, 3 ' -/V-bridged macrolides useful in treatment of inflammatory diseases. More particularly, the invention relates to 2 ' -O, 3 ' -/V-bridged 14- membered macrolides and to 2 ' - O, 3 ' -/V-bridged 15-membered azalide macrolides useful in treatment of neutrophil dominated inflammatory diseases resulting from neutrophilic infiltration and/or diseases associated with altered cellular functionality of neutrophils, to intermediates for their preparation, to the methods for their preparation, to their use as therapeutic agents, and to salts thereof.

  公开号：

  WO2009130189A1
• 作为产物：
  描述：

  阿奇霉素 A 在 碘 、 三羟甲基氨基甲烷 、 N-碘代丁二酰亚胺 作用下， 以 乙腈 为溶剂， 生成 3',9'-bis-N-desmethyl azithromycin
  参考文献：
  名称：

  [EN] 2'-O,3'-N-BRIDGED MACROLIDES
  [FR] MACROLIDES 2'-O,3'-N-PONTÉS

  摘要：

  ' -O, 3 ' -/V-bridged macrolides useful in treatment of inflammatory diseases. More particularly, the invention relates to 2 ' -O, 3 ' -/V-bridged 14- membered macrolides and to 2 ' - O, 3 ' -/V-bridged 15-membered azalide macrolides useful in treatment of neutrophil dominated inflammatory diseases resulting from neutrophilic infiltration and/or diseases associated with altered cellular functionality of neutrophils, to intermediates for their preparation, to the methods for their preparation, to their use as therapeutic agents, and to salts thereof.

  公开号：

  WO2009130189A1

文献信息

• Macrocyclic Compounds And Methods Of Making And Using The Same
  申请人：Farmer J. Jay

  公开号：US20080045585A1

  公开（公告）日：2008-02-21

  The present invention provides macrocyclic compounds useful as therapeutic agents. More particularly, these compounds are useful as anti-infective, anti-proliferative, anti-inflammatory, and prokinetic agents.

  本发明提供了一种用作治疗剂的大环化合物。更具体地说，这些化合物可用作抗感染、抗增殖、抗炎和促动力剂。
• MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME
  申请人：Farmer Jay J.

  公开号：US20120252747A1

  公开（公告）日：2012-10-04

  The present invention provides macrocyclic compounds useful as therapeutic agents of the formula: or a pharmaceutically acceptable salt, ester, N-oxide, or prodrug thereof, wherein T, R 1 , R 2 , R 3 , D, E, F, and G are as defined herein. More particularly, these compounds are useful as anti-infective, antiproliferative, anti-inflammatory and prokinetic agents.

  本发明提供了通式为的大环化合物，可用作治疗剂，或其药学上可接受的盐、酯、N-氧化物或前药，其中T、R1、R2、R3、D、E、F和G如本文所定义。更具体地，这些化合物可用作抗感染、抗增殖、抗炎和促动力剂。
• [EN] MACROCYCLIC COMPOUNDS AND METHODS OF MAKING AND USING THE SAME<br/>[FR] COMPOSES MACROCYCLIQUES ET LEURS PROCEDES DE FABRICATION ET D'UTILISATION
  申请人：RIB X PHARMACEUTICALS INC

  公开号：WO2005085266A3

  公开（公告）日：2006-01-05
• US8202843B2
  申请人：——

  公开号：US8202843B2

  公开（公告）日：2012-06-19
• US8841263B2
  申请人：——

  公开号：US8841263B2

  公开（公告）日：2014-09-23