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CHEBI:185805 - Pefloxacin N-oxide

ChEBI IDCHEBI:185805
ChEBI NamePefloxacin N-oxide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20FN3O4
Net Charge0
Average Mass349.362
Monoisotopic Mass349.14378
SMILESCC[N+]1([O-])C=C(C(=O)O)C(=O)c2cc(F)c(N3CCN(C)CC3)cc21
InChIInChI=1S/C17H20FN3O4/c1-3-21(25)10-12(17(23)24)16(22)11-8-13(18)14(9-15(11)21)20-6-4-19(2)5-7-20/h8-10H,3-7H2,1-2H3,(H,23,24)
InChIKeyLJTKAUAKTFMWRP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Pefloxacin N-oxide (CHEBI:185805) is a quinolines (CHEBI:26513)
IUPAC Name 
1-ethyl-6-luoro-7-(4-methylpiperazin-1-yl)-1-oxido-4-oxoquinolin-1-ium-3-carboxylic acid
Manual XrefsDatabases
HMDB0060613HMDB
118880ChemSpider
Registry NumbersSources
CAS:85145-21-7ChemIDplus