EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:32015 - Piretanide

ChEBI IDCHEBI:32015
ChEBI NamePiretanide
Stars
Secondary ChEBI IDCHEBI:93532
Last Modified6 March 2017
DownloadsMolfile
FormulaC17H18N2O5S
Net Charge0
Average Mass362.407
Monoisotopic Mass362.09364
SMILESNS(=O)(=O)c1cc(C(=O)O)cc(N2CCCC2)c1Oc1ccccc1
InChIInChI=1S/C17H18N2O5S/c18-25(22,23)15-11-12(17(20)21)10-14(19-8-4-5-9-19)16(15)24-13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)(H2,18,22,23)
InChIKeyUJEWTUDSLQGTOA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Piretanide (CHEBI:32015) is a aromatic ether (CHEBI:35618)
Synonyms  Source
PiretanideKEGG COMPOUND
arelixDrugCentral
eurelixDrugCentral
diumaxDrugCentral
Manual XrefsDatabases
D01634KEGG DRUG
LSM-3959LINCS
2201DrugCentral
Registry NumbersSources
CAS:55837-27-9KEGG COMPOUND
CAS:55837-27-9DrugCentral