2-[[1-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylamino]ethanesulfonic acid

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘧啶核苷
• 英文名称: 2-[[1-[3,4-Dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylamino]ethanesulfonic acid
• 英文别名: 2-[[1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylamino]ethanesulfonic acid
• 化学式: C₁₂H₁₉N₃O₈S₂
• 分子量: 397.4
• InChiKey: XMIFBEZRFMTGRL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -5.2
• 重原子数：
  25
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  209
• 氢给体数：
  6
• 氢受体数：
  10

文献信息

• METHOD FOR DETECTING MITOCHONDRIAL tRAN MODIFICATION
  申请人：NATIONAL UNIVERSITY CORPORATION KUMAMOTO UNIVERSITY

  公开号：US20190345551A1

  公开（公告）日：2019-11-14

  An exemplary method can be provided for detecting a modified nucleoside of mitochondrial transition RNA (mt-tRNA). Another exemplary method can be provided for detecting a modified nucleoside in mt-tRNA, which can use tandem mass analysis. For exemplary, it is possible to detect a modified nucleoside (for example, 5-taurinomethyl-2-thiouridine (τm5s2U), 5-taurinomethyluridine (τm5U), 2-methylthio-N6-isopentenyl adenosine (ms2i6A)) in a body fluid sample such as urine or a sample of cell culture supernatant.