benzyl N-[2-[(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6S)-4,5-dihydroxy-3-(phenylmethoxycarbonylamino)-6-(phenylmethoxycarbonylaminomethyl)oxan-2-yl]oxy-2-[(1R,2S,3R,5S,6R)-2-hydroxy-6-[(2R,3R,6S)-6-(hydroxymethyl)-3-(phenylmethoxycarbonylamino)oxan-2-yl]oxy-3-[[(2S)-2-hydroxy-4-(phenylmethoxycarbonylamino)butanoyl]amino]-5-(phenylmethoxycarbonylamino)cyclohexyl]oxy-5-(hydroxymethyl)oxolan-3-yl]oxyethyl]-N-(2-phenylethyl)carbamate | 940287-06-9

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: benzyl N-[2-[(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6S)-4,5-dihydroxy-3-(phenylmethoxycarbonylamino)-6-(phenylmethoxycarbonylaminomethyl)oxan-2-yl]oxy-2-[(1R,2S,3R,5S,6R)-2-hydroxy-6-[(2R,3R,6S)-6-(hydroxymethyl)-3-(phenylmethoxycarbonylamino)oxan-2-yl]oxy-3-[[(2S)-2-hydroxy-4-(phenylmethoxycarbonylamino)butanoyl]amino]-5-(phenylmethoxycarbonylamino)cyclohexyl]oxy-5-(hydroxymethyl)oxolan-3-yl]oxyethyl]-N-(2-phenylethyl)carbamate
• CAS: 940287-06-9
• 化学式: C₈₅H₁₀₁N₇O₂₆
• 分子量: 1636.77
• InChiKey: FGWOWPVNNKMMMK-QEEKKOMBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  118
• 可旋转键数：
  43
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  436
• 氢给体数：
  12
• 氢受体数：
  26

反应信息

• 作为反应物：
  描述：

  benzyl N-[2-[(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6S)-4,5-dihydroxy-3-(phenylmethoxycarbonylamino)-6-(phenylmethoxycarbonylaminomethyl)oxan-2-yl]oxy-2-[(1R,2S,3R,5S,6R)-2-hydroxy-6-[(2R,3R,6S)-6-(hydroxymethyl)-3-(phenylmethoxycarbonylamino)oxan-2-yl]oxy-3-[[(2S)-2-hydroxy-4-(phenylmethoxycarbonylamino)butanoyl]amino]-5-(phenylmethoxycarbonylamino)cyclohexyl]oxy-5-(hydroxymethyl)oxolan-3-yl]oxyethyl]-N-(2-phenylethyl)carbamate 、 对甲苯磺酰氯 在 吡啶 作用下， 生成
  参考文献：
  名称：

  WO2007/64954

  摘要：

  公开号：
• 作为产物：
  描述：

  苯甲氧羰酰琥珀酰亚胺 、 2"-O-phenylethylaminoethyl-penta-N-benzyloxycarbonyl-3',4'-dideoxy-N-1-haba paromomycin 在 碳酸氢钠 作用下， 以 1,4-二氧六环 、 水 为溶剂， 反应 6.0h， 以56%的产率得到benzyl N-[2-[(2S,3R,4R,5R)-4-[(2R,3R,4R,5S,6S)-4,5-dihydroxy-3-(phenylmethoxycarbonylamino)-6-(phenylmethoxycarbonylaminomethyl)oxan-2-yl]oxy-2-[(1R,2S,3R,5S,6R)-2-hydroxy-6-[(2R,3R,6S)-6-(hydroxymethyl)-3-(phenylmethoxycarbonylamino)oxan-2-yl]oxy-3-[[(2S)-2-hydroxy-4-(phenylmethoxycarbonylamino)butanoyl]amino]-5-(phenylmethoxycarbonylamino)cyclohexyl]oxy-5-(hydroxymethyl)oxolan-3-yl]oxyethyl]-N-(2-phenylethyl)carbamate
  参考文献：
  名称：

  WO2007/64954

  摘要：

  公开号：

文献信息

• ANTIBACTERIAL 4,5-SUBSTITUTED AMINOGLYCOSIDE ANALOGS HAVING MULTIPLE SUBSTITUENTS
  申请人：Swayze Eric E.

  公开号：US20080293649A1

  公开（公告）日：2008-11-27

  The present invention is directed to analogs of aminoglycoside compounds as well as their preparation and use as prophylactic or therapeutics against microbial infection.
• US7893039B2
  申请人：——

  公开号：US7893039B2

  公开（公告）日：2011-02-22