Name: Cefacetrile
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT212715396
Cas No:10206-21-0
常用名:Cefacetrile
别名:头孢乙腈, Cephacetrile, Celospor, Cefacetrilum, Cefacetrilo, Cefacetril
别名:头孢乙腈, Cephacetrile, Celospor, Cefacetrilum, Cefacetrilo, Cefacetril
IUPAC:(6R,7R)-3-[(acetyloxy)methyl]-7-(2-cyanoacetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
IUPAC:(6R,7R)-3-[(acetyloxy)methyl]-7-(2-cyanoacetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
InChI key:RRYMAQUWDLIUPV-BXKDBHETSA-N

分子式:C13H13N3O6S
分子量:339.32
氢键供体数 (HBD):2
氢键受体数 (HBA):6
LogP:-1.780771
SMILES:CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)CC#N)C2=O)C(O)=O |t:5|
SMILES:CC(=O)OCC1=C(N2[C@H](SC1)[C@H](NC(=O)CC#N)C2=O)C(O)=O |t:5|

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