1-[N-(2-succinamidylethyl)amino]anthraquinone | 332180-17-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 1-[N-(2-succinamidylethyl)amino]anthraquinone
• 英文别名: 4-[2-[(9,10-Dioxoanthracen-1-yl)amino]ethylamino]-4-oxobutanoic acid；4-[2-[(9,10-dioxoanthracen-1-yl)amino]ethylamino]-4-oxobutanoic acid
• CAS: 332180-17-3
• 化学式: C₂₀H₁₈N₂O₅
• 分子量: 366.373
• InChiKey: BJTFQBAGGUOLFQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  113
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  1-[N-(2-succinamidylethyl)amino]anthraquinone 、 alkaline earth salt of/the/ methylsulfuric acid 在 benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate 、 N,N-二异丙基乙胺 、 乙二胺四乙酸 、 三异丙基硅烷 、 三氟乙酸 作用下， 以 N,N-二甲基甲酰胺 、 水 为溶剂， 反应 8.0h， 生成 (2S)-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2R)-2-[[(2S)-6-amino-2-[[(2S)-2-[[4-[2-[(9,10-dioxoanthracen-1-yl)amino]ethylamino]-4-oxobutanoyl]amino]propanoyl]amino]hexanoyl]amino]-3-sulfanylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-oxobutanoyl]amino]propanoic acid
  参考文献：
  名称：

  Anthraquinone-peptides as inhibitors of AP-1 transcription factor

  摘要：

  Peptide-1-[N-{2-succinamidylethyl}amino]anthraquinones containing five-seven amino acid residues including the KCR motif important in AP-1 protein binding to DNA have been synthesised as potential transcription factor inhibitors. These anthraquinone-peptides showed DNA intercalative binding and inhibition of AP-I protein binding to its DNA consensus sequence. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00653-3
• 作为产物：
  描述：

  1-氯蒽醌 以 N,N-二甲基甲酰胺 为溶剂， 反应 75.0h， 生成 1-[N-(2-succinamidylethyl)amino]anthraquinone
  参考文献：
  名称：

  Anthraquinone-peptides as inhibitors of AP-1 transcription factor

  摘要：

  Peptide-1-[N-{2-succinamidylethyl}amino]anthraquinones containing five-seven amino acid residues including the KCR motif important in AP-1 protein binding to DNA have been synthesised as potential transcription factor inhibitors. These anthraquinone-peptides showed DNA intercalative binding and inhibition of AP-I protein binding to its DNA consensus sequence. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00653-3

文献信息

• Anthraquinone-peptides as inhibitors of AP-1 transcription factor
  作者：Taeeba Ijaz、Phoung Tran、Ketan C. Ruparelia、Paul H. Teesdale-Spittle、Samantha Orr、Laurence H. Patterson

  DOI：10.1016/s0960-894x(00)00653-3

  日期：2001.2

  Peptide-1-[N-2-succinamidylethyl}amino]anthraquinones containing five-seven amino acid residues including the KCR motif important in AP-1 protein binding to DNA have been synthesised as potential transcription factor inhibitors. These anthraquinone-peptides showed DNA intercalative binding and inhibition of AP-I protein binding to its DNA consensus sequence. (C) 2001 Elsevier Science Ltd. All rights reserved.