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CHEBI:228833 - O1-[4-(tert-butyl)benzoyl]-2-(tert-butylsulfonyl)ethanehydroximamide

ChEBI IDCHEBI:228833
ChEBI NameO1-[4-(tert-butyl)benzoyl]-2-(tert-butylsulfonyl)ethanehydroximamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26N2O4S
Net Charge0
Average Mass354.472
Monoisotopic Mass354.16133
SMILESCC(C)(C)c1ccc(C(=O)ON=C(N)CS(=O)(=O)C(C)(C)C)cc1
InChIInChI=1S/C17H26N2O4S/c1-16(2,3)13-9-7-12(8-10-13)15(20)23-19-14(18)11-24(21,22)17(4,5)6/h7-10H,11H2,1-6H3,(H2,18,19)
InChIKeyICWLEGNPHRIEGC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
O1-[4-(tert-butyl)benzoyl]-2-(tert-butylsulfonyl)ethanehydroximamide (CHEBI:228833) is a benzoic acids (CHEBI:22723)
IUPAC Name 
[(1-amino-2-tert-butylsulonylethylidene)amino] 4-tert-butylbenzoate
Manual XrefsDatabases
2097852ChemSpider