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CHEBI:167761 - Ofloxacin impurity e

ChEBI IDCHEBI:167761
ChEBI NameOfloxacin impurity e
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H18FN3O4
Net Charge0
Average Mass347.346
Monoisotopic Mass347.12813
SMILESC[C@H]1COc2c(N3CCNCC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
InChIInChI=1S/C17H18FN3O4/c1-9-8-25-16-13-10(15(22)11(17(23)24)7-21(9)13)6-12(18)14(16)20-4-2-19-3-5-20/h6-7,9,19H,2-5,8H2,1H3,(H,23,24)/t9-/m0/s1
InChIKeyWKRSSAPQZDHYRV-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) MetaboLights (MTBLS2542)
ChEBI Ontology
Outgoing Relation(s)
Ofloxacin impurity e (CHEBI:167761) is a quinolines (CHEBI:26513)
IUPAC Name 
7-luoro-2-methyl-10-oxo-6-piperazin-1-yl-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
Manual XrefsDatabases
9899949ChemSpider
Registry NumbersSources
CAS:82419-52-1ChemIDplus