CHEBI:167761 - Ofloxacin impurity e

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Ofloxacin impurity e
ChEBI ID CHEBI:167761
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H18FN3O4
Net Charge 0
Average Mass 347.346
Monoisotopic Mass 347.12813
InChI InChI=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
InChIKey WKRSSAPQZDHYRV-VIFPVBQESA-N
SMILES FC1=C(N2CCNCC2)C=3OC[C@H](C)N4C3C(=C1)C(=O)C(C(=O)O)=C4
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood serum (BTO:0000133). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
9899949 ChemSpider
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Registry Number Type Source
82419-52-1 CAS Registry Number ChemIDplus