4-[(3S,6S)-6-[(3R,4R,6S)-6-[[(6S,7S)-7-[(1S,3S,4R)-4-(3-carboxypropanoyloxy)-3-hydroxy-1-methoxy-2-oxopentyl]-6-[(2S,4R,5R)-4-[(2S,4R,5S)-4-[(2S,4S,5R)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-4-oxobutanoic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 4-[(3S,6S)-6-[(3R,4R,6S)-6-[[(6S,7S)-7-[(1S,3S,4R)-4-(3-carboxypropanoyloxy)-3-hydroxy-1-methoxy-2-oxopentyl]-6-[(2S,4R,5R)-4-[(2S,4R,5S)-4-[(2S,4S,5R)-4,5-dihydroxy-4,6-dimethyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-5-hydroxy-6-methyloxan-2-yl]oxy-4,10-dihydroxy-3-methyl-5-oxo-7,8-dihydro-6H-anthracen-2-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-4-oxobutanoic acid
• 化学式: C₆₀H₈₄O₃₀
• 分子量: 1285.3
• InChiKey: QHTICKJLHLAVQE-OOKWKCGMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  90
• 可旋转键数：
  25
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  445
• 氢给体数：
  11
• 氢受体数：
  30

文献信息

• US8772253B2
  申请人：——

  公开号：US8772253B2

  公开（公告）日：2014-07-08