5-(3-amino-3-carboxypropyl)-2,3,8,9,10,11,11a,11b-octahydro-1H-pyrido[2,1-f][1,6]naphthyridine-3-carboxylic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 5-(3-amino-3-carboxypropyl)-2,3,8,9,10,11,11a,11b-octahydro-1H-pyrido[2,1-f][1,6]naphthyridine-3-carboxylic acid
• 化学式: C₁₇H₂₅N₃O₄
• 分子量: 335.4
• InChiKey: FCKFWNBMOKKZJC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -1.7
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  116
• 氢给体数：
  3
• 氢受体数：
  7

文献信息

• PIGMENT COMPOUND, METHOD OF PRODUCING THE SAME, AND COLORING AGENT
  申请人：Nakano Hiroshi

  公开号：US20110178303A1

  公开（公告）日：2011-07-21

  An object of the present invention is to provide a novel plant-derived pigment compound, which is a pigment compound represented by Formula II: (wherein R 1 to R 3 independently represent a hydroxyl group or an alkoxy group having 1 to 4 carbon atoms, and R 4 and R 5 independently represent a hydrogen atom, an acyl group having 1 to 4 carbon atoms, or an alkyl group having 1 to 4 carbon atoms). The compound is a yellow pigment extracted from the endosperm or the like of the rice cultivar “Hatsuyamabuki.”