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CHEBI:3478 - cefaclor

ChEBI IDCHEBI:3478
ChEBI Namecefaclor
Stars
DefinitionA cephalosporin bearing chloro and (R)-2-amino-2-phenylacetamido groups at positions 3 and 7, respectively, of the cephem skeleton.
Secondary ChEBI IDCHEBI:472656
Last Modified9 February 2018
DownloadsMolfile
FormulaC15H14ClN3O4S
Net Charge0
Average Mass367.814
Monoisotopic Mass367.03935
SMILES[H][C@]12SCC(Cl)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)[C@H](N)c1ccccc1
InChIInChI=1S/C15H14ClN3O4S/c16-8-6-24-14-10(13(21)19(14)11(8)15(22)23)18-12(20)9(17)7-4-2-1-3-5-7/h1-5,9-10,14H,6,17H2,(H,18,20)(H,22,23)/t9-,10-,14-/m1/s1
InChIKeyQYIYFLOTGYLRGG-GPCCPHFNSA-N
Wikipedia
Roles Classification
Biological Roles:
antibacterial drug  A drug used to treat or prevent bacterial infections.
drug allergen  Any drug which causes the onset of an allergic reaction.
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.
Applications:
antibacterial drug  A drug used to treat or prevent bacterial infections.
drug allergen  Any drug which causes the onset of an allergic reaction.
drug allergen  Any drug which causes the onset of an allergic reaction.
ChEBI Ontology
Outgoing Relation(s)
cefaclor (CHEBI:3478) has role antibacterial drug (CHEBI:36047)
cefaclor (CHEBI:3478) has role drug allergen (CHEBI:88188)
cefaclor (CHEBI:3478) is a cephalosporin (CHEBI:23066)
IUPAC Names 
(6R,7R)-7-{[(2R)-2-amino-2-phenylacetyl]amino}-3-chloro-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
7β-{[(2R)-2-amino-2-phenylacetyl]amino}-3-chloro-3,4-didehydrocepham-4-carboxylic acid
INN  Source
cefaclorumDrugBank
Synonyms  Source
CefaclorKEGG COMPOUND
cefaclorChEMBL
Cefaclor anhydrousChemIDplus
CCLKEGG DRUG
3-Chloro-7-D-(2-phenylglycinamido)-3-cephem-4-carboxylic acidChemIDplus
CephaclorChemIDplus
Manual XrefsDatabases
C06877KEGG COMPOUND
D00256KEGG DRUG
DB00833DrugBank
DE2408698Patent
US3925372Patent
CefaclorWikipedia
HMDB0014971HMDB
LSM-5368LINCS
525DrugCentral
Registry NumbersSources
Reaxys:3632473Reaxys
CAS:53994-73-3KEGG COMPOUND
CAS:53994-73-3ChemIDplus
CAS:53994-73-3KEGG DRUG
CAS:53994-73-3DrugBank
Citations