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HIT212103522
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HIT212103522
  • HIT ID:HIT212103522
  • Cas No:89919-62-0;2450-53-5
  • 常用名:(-)-3,5-Dicaffeoylquinic acid
  • 别名:Isochlorogenic Acid A, 3,5-Dicaffeoylquinic Acid, (-)-3,5-二咖啡酰奎宁酸, (-)-3,5-Dicaffeoyl quinic acid
    别名:Isochlorogenic Acid A, 3,5-Dicaffeoylquinic Acid, (-)-3,5-二咖啡酰奎宁酸, (-)-3,5-Dicaffeoyl quinic acid
  • IUPAC:(1S,3R,4S,5R)-3,5-bis({[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-1,4-dihydroxycyclohexane-1-carboxylic acid
    IUPAC:(1S,3R,4S,5R)-3,5-bis({[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})-1,4-dihydroxycyclohexane-1-carboxylic acid
  • InChI key:KRZBCHWVBQOTNZ-PSEXTPKNSA-N
  • 分子式:C25H24O12
  • 分子量:516.455
  • 氢键供体数 (HBD):7
  • 氢键受体数 (HBA):10
  • LogP:2.158
  • SMILES:O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1 |wU:4.4,1.0,7.8,wD:2.25,4.22,(-.8,-.62,;-.8,.92,;-2.13,1.69,;-2.13,3.23,;-.8,4,;-1.79,5.18,;.53,3.23,;.53,1.69,;1.87,.92,;3.2,1.69,;3.2,3.23,;4.53,.92,;5.87,1.69,;7.2,.92,;8.53,1.69,;9.87,.92,;9.87,-.62,;11.2,-1.39,;8.53,-1.39,;8.53,-2.93,;7.2,-.62,;.19,5.18,;-.34,6.63,;1.71,4.92,;-3.47,.92,;-3.47,-.62,;-2.13,-1.39,;-4.8,-1.39,;-4.8,-2.93,;-6.14,-3.7,;-6.14,-5.24,;-7.47,-6.01,;-8.8,-5.24,;-10.14,-6.01,;-8.8,-3.7,;-10.14,-2.93,;-7.47,-2.93,)|
    SMILES:O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1 |wU:4.4,1.0,7.8,wD:2.25,4.22,(-.8,-.62,;-.8,.92,;-2.13,1.69,;-2.13,3.23,;-.8,4,;-1.79,5.18,;.53,3.23,;.53,1.69,;1.87,.92,;3.2,1.69,;3.2,3.23,;4.53,.92,;5.87,1.69,;7.2,.92,;8.53,1.69,;9.87,.92,;9.87,-.62,;11.2,-1.39,;8.53,-1.39,;8.53,-2.93,;7.2,-.62,;.19,5.18,;-.34,6.63,;1.71,4.92,;-3.47,.92,;-3.47,-.62,;-2.13,-1.39,;-4.8,-1.39,;-4.8,-2.93,;-6.14,-3.7,;-6.14,-5.24,;-7.47,-6.01,;-8.8,-5.24,;-10.14,-6.01,;-8.8,-3.7,;-10.14,-2.93,;-7.47,-2.93,)|
  • (-)-3,5-Dicaffeoylquinic acid (Standard) 是 (-)-3,5-Dicaffeoylquinic acid 的标准品。适用于定量分析、质量控制及生化实验等相关研究。3,5-O-Dicaffeoylquinic acid (Isochlorogenic Acid A) 能够改善由三甲基锡诱导的学习和记忆缺陷。
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    TargetMolSC
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    AnalyticonSC
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    AA BlocksBB
    规格
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    4-6周
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    -
    待询
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