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CHEBI:183837 - Danofloxacin

ChEBI IDCHEBI:183837
ChEBI NameDanofloxacin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20FN3O3
Net Charge0
Average Mass357.385
Monoisotopic Mass357.14887
SMILES[H][C@]12CN(c3cc4c(cc3F)c(=O)c(C(=O)O)cn4C3CC3)[C@]([H])(CN1C)C2
InChIInChI=1S/C19H20FN3O3/c1-21-7-12-4-11(21)8-22(12)17-6-16-13(5-15(17)20)18(24)14(19(25)26)9-23(16)10-2-3-10/h5-6,9-12H,2-4,7-8H2,1H3,(H,25,26)/t11-,12-/m0/s1
InChIKeyQMLVECGLEOSESV-RYUDHWBXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) serum (BTO:0001239) MetaboLights (MTBLS3487) Strain: C57BL [EFO:0005181]
ChEBI Ontology
Outgoing Relation(s)
Danofloxacin (CHEBI:183837) is a quinolines (CHEBI:26513)
IUPAC Name 
1-cyclopropyl-6-luoro-7-[(1S,4S)-5-methyl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-4-oxoquinoline-3-carboxylic acid
Manual XrefsDatabases
DB11393DrugBank
D07774KEGG DRUG
64439ChemSpider
Registry NumbersSources
CAS:112398-08-0ChemIDplus