(2S)-2-amino-5-[[6-amino-9-(1,3-dihydro-2-benzofuran-1-yl)-9H-xanthen-3-yl]amino]-5-oxopentanoic acid

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (2S)-2-amino-5-[[6-amino-9-(1,3-dihydro-2-benzofuran-1-yl)-9H-xanthen-3-yl]amino]-5-oxopentanoic acid
• 化学式: C₂₆H₂₅N₃O₅
• 分子量: 459.5
• InChiKey: NNMFECXUVJHGJK-LXKSKSEUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.6
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  137
• 氢给体数：
  4
• 氢受体数：
  7

文献信息

• METHOD FOR DIAGNOSING CANCER
  申请人：THE UNIVERSITY OF TOKYO

  公开号：US20140206992A1

  公开（公告）日：2014-07-24

  Methods for identifying the presence of cancerous cells or tissue by: applying a compound of formula (I), or salts thereof, to a living body, wherein R 1 represents hydrogen or the same or different one to four substituents; R 2 , R 3 , R 4 , R 5 , R 6 , and R 7 independently represent hydrogen, hydroxy, alkyl, or halogen; R 8 and R 9 independently represent hydrogen or alkyl; and X represents C 1 -C 3 alkylene; and detecting fluorescence emitted by a compound of formula (II), wherein R 1 , R 2 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , and R 9 are as defined above; wherein fluorescence emitted by a compound of formula (II) is indicative of the presence of cancerous cells or tissue.
• US9610366B2
  申请人：——

  公开号：US9610366B2

  公开（公告）日：2017-04-04