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CHEBI:44237 - N-butylbenzenesulfonamide

Default Structure
ChEBI IDCHEBI:44237
ChEBI NameN-butylbenzenesulfonamide
Stars
ASCII NameN-butylbenzenesulfonamide
DefinitionA sulfonamide that is benzenesulfonamide substituted by a butyl group at the nitrogen atom. It has been isolated from the plant Prunus africana and has been shown to exhibit antiandrogenic activity.
Last Modified11 November 2014
DownloadsMolfile
FormulaC10H15NO2S
Net Charge0
Average Mass213.302
Monoisotopic Mass213.08235
SMILESCCCCNS(=O)(=O)c1ccccc1
InChIInChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
InChIKeyIPRJXAGUEGOFGG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Prunus africana (ncbitaxon:379279) - PubMed (16783690)
Roles Classification
Biological Roles:
neurotoxin  A poison that interferes with the functions of the nervous system.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
N-butylbenzenesulfonamide (CHEBI:44237) has role neurotoxin (CHEBI:50910)
N-butylbenzenesulfonamide (CHEBI:44237) has role plant metabolite (CHEBI:76924)
N-butylbenzenesulfonamide (CHEBI:44237) is a sulfonamide (CHEBI:35358)
IUPAC Name 
N-butylbenzenesulfonamide
Synonyms  Source
Benzenesulfonic acid butyl amideChemIDplus
Dellatol BBSNIST Chemistry WebBook
N-(n-Butyl)benzenesulfonamideNIST Chemistry WebBook
Plastomoll BMBNIST Chemistry WebBook
Manual XrefsDatabases
CA2596618Patent
NBBPDBeChem
WO2006081994Patent
Registry NumbersSources
Reaxys:2725965Reaxys
CAS:3622-84-2NIST Chemistry WebBook
CAS:3622-84-2ChemIDplus
Citations