[(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 5-hydroxy-4-methoxy-2-(3-oxoprop-1-enyl)benzoate

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: [(2R,3S,4S,5R,6R)-6-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl 5-hydroxy-4-methoxy-2-(3-oxoprop-1-enyl)benzoate
• 化学式: C₂₃H₃₀O₁₅
• 分子量: 546.5
• InChiKey: IKYRSFLWWHZUIV-MDSMXMBJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.5
• 重原子数：
  38
• 可旋转键数：
  11
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  242
• 氢给体数：
  8
• 氢受体数：
  15

文献信息

• PHENYLPROPANOID SACCHARIDE ESTERS, METHODS AND USES THEREOF
  申请人：UNIVERSIDADE NOVA DE LISBOA

  公开号：EP3938374A2

  公开（公告）日：2022-01-19
• [EN] PHENYLPROPANOID SACCHARIDE ESTERS, METHODS AND USES THEREOF<br/>[FR] ESTERS DE SACCHARIDE PHÉNYLPROPANOÏDES, LEURS MÉTHODES ET UTILISATIONS
  申请人：UNIV NOVA DE LISBOA

  公开号：WO2020183442A2

  公开（公告）日：2020-09-17

  The present disclosure relates to phenylpropanoid saccharide esters, methods for the synthesis of libraries of phenylpropanoid saccharide esters with different degree and place of substitution in the sugar core, and their use as antimicrobial agents, cytotoxic agents and/or antitumoral agents. The present disclosure relates to a compound for formula I wherein R1, R2, R3 and R4 are independently selected from each other; R1 is selected from H or COCH3, R2, R3 and R4 is selected from H, OCH3, OH, for use in a method for the treatment of a microbial infection, or for use in a method for the treatment of a fungal infection or for use in a method for the treatment of cancer.