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CHEBI:49541 - 7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrile

Default Structure
ChEBI IDCHEBI:49541
ChEBI Name7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrile
Stars
Last Modified30 April 2024
DownloadsMolfile
FormulaC9H2N4O4
Net Charge0
Average Mass230.139
Monoisotopic Mass230.00760
SMILES[H]c1c(C#N)c([N+](=O)[O-])c([H])c2c1=NC(=O)C(=O)N=2
InChIInChI=1S/C9H2N4O4/c10-3-4-1-5-6(2-7(4)13(16)17)12-9(15)8(14)11-5/h1-2H
InChIKeyIAWXTSMHXFRLQR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100) Strain: C57BL/6J
ChEBI Ontology
Outgoing Relation(s)
7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrile (CHEBI:49541) is a unclassifieds (CHEBI:27189)
Synonym  Source
7-nitro-2,3-dioxo-2,3-dihydroquinoxaline-6-carbonitrilePDBeChem
Manual XrefsDatabases
CNIPDBeChem