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CHEBI:192486 - ciprofloxacin(1+)

ChEBI IDCHEBI:192486
ChEBI Nameciprofloxacin(1+)
Stars
DefinitionA secondary ammonium ion that is the conjugate acid of ciprofloxacin resulting from the protonation of the NH group; major species at acidic pH.
Last Modified23 June 2022
SubmitterR. Stephan
DownloadsMolfile
FormulaC17H19FN3O3
Net Charge+1
Average Mass332.355
Monoisotopic Mass332.14050
SMILESO=C(O)c1cn(C2CC2)c2cc(N3CC[NH2+]CC3)c(F)cc2c1=O
InChIInChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)/p+1
InChIKeyMYSWGUAQZAJSOK-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
ciprofloxacin(1+) (CHEBI:192486) is a secondary ammonium ion (CHEBI:137419)
ciprofloxacin(1+) (CHEBI:192486) is conjugate acid of ciprofloxacin (CHEBI:100241)
Incoming Relation(s)
ciprofloxacin (CHEBI:100241) is conjugate base of ciprofloxacin(1+) (CHEBI:192486)
IUPAC Name 
4-(3-carboxy-1-cyclopropyl-6-fluoro-4-oxo-1,4-dihydroquinolin-7-yl)piperazin-1-ium
Synonym  Source
ciprofloxacin cationChEBI
Citations