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CHEBI:64490 - 4-nitrosobenzenesulfonamide

ChEBI IDCHEBI:64490
ChEBI Name4-nitrosobenzenesulfonamide
Stars
DefinitionA sulfonamide that is benzenesulfonamide bearing a nitroso substituent at position 4.
Last Modified12 March 2019
SubmitterSteve
DownloadsMolfile
FormulaC6H6N2O3S
Net Charge0
Average Mass186.192
Monoisotopic Mass186.00991
SMILESNS(=O)(=O)c1ccc(N=O)cc1
InChIInChI=1S/C6H6N2O3S/c7-12(10,11)6-3-1-5(8-9)2-4-6/h1-4H,(H2,7,10,11)
InChIKeyNMCOEEKSSIVNAX-UHFFFAOYSA-N
Roles Classification
Biological Roles:
hapten  Any substance capable of eliciting an immune response only when attached to a large carrier such as a protein. Examples include dinitrophenols; oligosaccharides; peptides; and heavy metals.
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
ChEBI Ontology
Outgoing Relation(s)
4-nitrosobenzenesulfonamide (CHEBI:64490) has role allergen (CHEBI:50904)
4-nitrosobenzenesulfonamide (CHEBI:64490) has role hapten (CHEBI:59174)
4-nitrosobenzenesulfonamide (CHEBI:64490) is a nitroso compound (CHEBI:35800)
4-nitrosobenzenesulfonamide (CHEBI:64490) is a sulfonamide (CHEBI:35358)
IUPAC Name 
4-nitrosobenzenesulfonamide
Registry NumbersSources
Reaxys:2692516Reaxys
Citations