CHEBI:53016 - sulfamethoxazole hydroxylamine

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ChEBI Name sulfamethoxazole hydroxylamine
ChEBI ID CHEBI:53016
Definition A sulfonamide compound having a 4-hydroxylaminophenyl group attached to the sulfur atom and a 1,2-oxazol-3-yl group attached to the nitrogen atom.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C10H11N3O4S
Net Charge 0
Average Mass 269.27700
Monoisotopic Mass 269.04703
InChI InChI=1S/C10H11N3O4S/c1-7-6-10(12-17-7)13-18(15,16)9-4-2-8(11-14)3-5-9/h2-6,11,14H,1H3,(H,12,13)
InChIKey MJAMPGKHIZXVFJ-UHFFFAOYSA-N
SMILES Cc1cc(NS(=O)(=O)c2ccc(NO)cc2)no1
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sulfamethoxazole hydroxylamine (CHEBI:53016) has functional parent sulfamethoxazole (CHEBI:9332)
sulfamethoxazole hydroxylamine (CHEBI:53016) has functional parent sulfanilamide (CHEBI:45373)
sulfamethoxazole hydroxylamine (CHEBI:53016) has role allergen (CHEBI:50904)
sulfamethoxazole hydroxylamine (CHEBI:53016) has role metabolite (CHEBI:25212)
sulfamethoxazole hydroxylamine (CHEBI:53016) is a isoxazoles (CHEBI:55373)
sulfamethoxazole hydroxylamine (CHEBI:53016) is a sulfonamide (CHEBI:35358)
IUPAC Name
4-(hydroxyamino)-N-(5-methylisoxazol-3-yl)benzenesulfonamide
Synonyms Sources
4-(Hydroxyamino)-N-(5-methyl-3-isoxazolyl)benzenesulfonamide ChemIDplus
Smx-HA ChemIDplus
SMX-NHOH ChEBI
Sulfamethoxazole hydroxylamine ChemIDplus
Registry Numbers Types Sources
114438-33-4 CAS Registry Number ChemIDplus
6336217 Reaxys Registry Number Reaxys
6336217 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
10506572 PubMed citation Europe PMC
10843725 PubMed citation Europe PMC
11350866 PubMed citation Europe PMC
11448455 PubMed citation Europe PMC
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1997005 PubMed citation Europe PMC
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19997042 PubMed citation Europe PMC
20221587 PubMed citation Europe PMC
7628308 PubMed citation Europe PMC
8062495 PubMed citation Europe PMC
Last Modified
11 March 2019