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CHEBI:187812 - Isounonal

ChEBI IDCHEBI:187812
ChEBI NameIsounonal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H12O5
Net Charge0
Average Mass296.278
Monoisotopic Mass296.06847
SMILESCc1c(O)c(C=O)c2oc(-c3ccccc3)cc(=O)c2c1O
InChIInChI=1S/C17H12O5/c1-9-15(20)11(8-18)17-14(16(9)21)12(19)7-13(22-17)10-5-3-2-4-6-10/h2-8,20-21H,1H3
InChIKeyTXZFBUWNWNHMCS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Isounonal (CHEBI:187812) is a flavones (CHEBI:24043)
IUPAC Name 
5,7-dihydroxy-6-methyl-4-oxo-2-phenylchromene-8-carbaldehyde
Manual XrefsDatabases
168345ChemSpider
LMPK12110177LIPID MAPS
Registry NumbersSources
CAS:55743-12-9ChemIDplus