(2S,4R,5R)-2-[(2S,3S,5S)-2-[(3S,5S,6R)-4,5-dihydroxy-6-[2-[4-[3-[2-[(2S,4R,5S)-5-hydroxy-6-[[(2R,3S,5S)-6-(hydroxymethyl)-5-phosphonooxy-3-[[(3R)-3-propanoyloxypentanoyl]amino]-4-[(3R)-3-propanoyloxypentanoyl]oxyoxan-2-yl]oxymethyl]-3-[[(3R)-3-hydroxypentanoyl]amino]-4-[(3R)-3-hydroxypentanoyl]oxyoxan-2-yl]oxyethylamino]-3-oxopropyl]triazol-1-yl]ethoxy]-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2-phenylacetyl)amino]-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: (2S,4R,5R)-2-[(2S,3S,5S)-2-[(3S,5S,6R)-4,5-dihydroxy-6-[2-[4-[3-[2-[(2S,4R,5S)-5-hydroxy-6-[[(2R,3S,5S)-6-(hydroxymethyl)-5-phosphonooxy-3-[[(3R)-3-propanoyloxypentanoyl]amino]-4-[(3R)-3-propanoyloxypentanoyl]oxyoxan-2-yl]oxymethyl]-3-[[(3R)-3-hydroxypentanoyl]amino]-4-[(3R)-3-hydroxypentanoyl]oxyoxan-2-yl]oxyethylamino]-3-oxopropyl]triazol-1-yl]ethoxy]-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-5-[(2-phenylacetyl)amino]-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
• 化学式: C₇₆H₁₂₀N₇O₄₂P
• 分子量: 1834.8
• InChiKey: COZVFYLXXREDRM-WRQPXTMUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -7.6
• 重原子数：
  126
• 可旋转键数：
  54
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.78
• 拓扑面积：
  732
• 氢给体数：
  21
• 氢受体数：
  44

文献信息

• US8809285B2
  申请人：——

  公开号：US8809285B2

  公开（公告）日：2014-08-19