2-(5-CYANO-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID

CAS号
CCD编号
CCD03286607
分子式
C14 H11 N3 O5
分子量
301.257

基本信息

产品名称: 2-(5-CYANO-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID
英文同义词: 2-(5-CYANO-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-3-(4-HYDROXY-PHENYL)-PROPIONIC ACID
MDL号: MFCD17015151
氢键受体数量: 8
氢键供体数量: 3
Smile: c1cc(ccc1CC(C(=O)O)n2cc(c(=O)[nH]c2=O)C#N)O
InChi: InChI=1S/C14H11N3O5/c15-6-9-7-17(14(22)16-12(9)19)11(13(20)21)5-8-1-3-10(18)4-2-8/h1-4,7,11,18H,5H2,(H,20,21)(H,16,19,22)
InChiKey: InChIKey=RBAAHZGGVLBHOJ-UHFFFAOYSA-N

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