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CHEBI:135437 - cefacetrile

ChEBI IDCHEBI:135437
ChEBI Namecefacetrile
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC13H13N3O6S
Net Charge0
Average Mass339.329
Monoisotopic Mass339.05251
SMILES[H][C@]12SCC(COC(C)=O)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)CC#N
InChIInChI=1S/C13H13N3O6S/c1-6(17)22-4-7-5-23-12-9(15-8(18)2-3-14)11(19)16(12)10(7)13(20)21/h9,12H,2,4-5H2,1H3,(H,15,18)(H,20,21)/t9-,12-/m1/s1
InChIKeyRRYMAQUWDLIUPV-BXKDBHETSA-N
Roles Classification
Biological Roles:
drug allergen  Any drug which causes the onset of an allergic reaction.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Application:
drug allergen  Any drug which causes the onset of an allergic reaction.
ChEBI Ontology
Outgoing Relation(s)
cefacetrile (CHEBI:135437) is a cephalosporin (CHEBI:23066)
Synonyms  Source
cephacetrileDrugCentral
cefacetrile sodiumDrugCentral
cephacetrilDrugCentral
Manual XrefsDatabases
524DrugCentral
HMDB0015484HMDB
Registry NumbersSources
CAS:10206-21-0DrugCentral