5'-O-triphosphoadenylyl-(2'->5')-adenylyl-(2'->5')-adenosine | 65954-93-0

• 分子结构分类: 有机化合物 - 核苷、核苷酸和类似物 - 嘌呤核苷酸
• 英文名称: 5'-O-triphosphoadenylyl-(2'->5')-adenylyl-(2'->5')-adenosine
• 英文别名: 5'-Triphosphoadenylyl(2'-5')adenylyl(2'-5')adenosine；5'-triphosphate of 2',5'-triadenylate；ppp5'A2'p5'A2'p5'A；pppA2'p5'A2'p5'A；adenylyl-(5'->2')-adenylyl-(5'->2')-O^5'-tetrahydroxy[1]triphosphoryl-adenosine；[[(2r,3r,4r,5r)-5-(6-Aminopurin-9-Yl)-4-[[(2r,3r,4r,5r)-5-(6-Aminopurin-9-Yl)-4-[[(2r,3s,4r,5r)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]methoxy-Hydroxy-Phosphoryl]oxy-3-Hydroxy-Oxolan-2-Yl]methoxy-Hydroxy-Phosphoryl]oxy-3-Hydroxy-Oxolan-2-Yl]methoxy-Hydroxy-Phosphoryl] Phosphono Hydrogen Phosphate；[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
• CAS: 65954-93-0
• 化学式: C₃₀H₄₀N₁₅O₂₅P₅
• 分子量: 1165.6
• InChiKey: RTAGLZBJCCVJET-UQTMIEBXSA-N

物化性质

• 密度：
  2.61±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -10.9
• 重原子数：
  75
• 可旋转键数：
  20
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  589
• 氢给体数：
  13
• 氢受体数：
  37