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CHEBI:180601 - 3,5-Dinitro-N-(2-oxo-2-phenylethyl)benzamide

ChEBI IDCHEBI:180601
ChEBI Name3,5-Dinitro-N-(2-oxo-2-phenylethyl)benzamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H11N3O6
Net Charge0
Average Mass329.268
Monoisotopic Mass329.06479
SMILESO=C(CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1
InChIInChI=1S/C15H11N3O6/c19-14(10-4-2-1-3-5-10)9-16-15(20)11-6-12(17(21)22)8-13(7-11)18(23)24/h1-8H,9H2,(H,16,20)
InChIKeyGSVUCDLHWYWCDS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) pancreas (BTO:0000988) MetaboLights (MTBLS1925) Strain: PANC-1 cell [BCGO:0000122]
ChEBI Ontology
Outgoing Relation(s)
3,5-Dinitro-N-(2-oxo-2-phenylethyl)benzamide (CHEBI:180601) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
3,5-dinitro-N-phenacylbenzamide
Manual XrefsDatabases
28683055ChemSpider