depsiechinoserine | 1146311-18-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: depsiechinoserine
• CAS: 1146311-18-3
• 化学式: C₅₁H₆₆N₁₂O₁₃S₂
• 分子量: 1119.29
• InChiKey: NATOSAUHEAARIR-VITLIGDRSA-N

物化性质

• 沸点：
  1423.1±65.0 °C(predicted)
• 密度：
  1.42±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.16
• 重原子数：
  78.0
• 可旋转键数：
  15.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  333.03
• 氢给体数：
  6.0
• 氢受体数：
  18.0

反应信息

• 作为产物：
  描述：

  Echinomycin 在 lithium hydroxide 、 水 作用下， 反应 0.17h， 生成 、 depsiechinoserine
  参考文献：
  名称：

  Structure–activity studies of echinomycin antibiotics against drug-resistant and biofilm-forming Staphylococcus aureus and Enterococcus faecalis

  摘要：

  Four echinomycin antibiotics were isolated from the culture broth of a marine streptomycete, and their structures were determined by a combination of chemical and spectroscopic analyses. Antibiotic activities were measured against drug-resistant and biofilm-forming strains of Staphylococcus aureus and Enterococcus faecalis. Minimum inhibitory concentrations ranging from 0.01 mu M to greater than 14 mu M clearly defined structure-activity relationships for antibiotic potency. Echinomycin was the most active compound with a MIC of 0.03 mu M against methicillin-resistant S. aureus and 0.01 mu M against biofilm-forming E. faecalis. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2009.01.010