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CHEBI:197795 - Carbonarone B

Default Structure
ChEBI IDCHEBI:197795
ChEBI NameCarbonarone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H11NO3
Net Charge0
Average Mass229.235
Monoisotopic Mass229.07389
SMILESO=Cc1c(O)cc(Cc2ccccc2)nc1=O
InChIInChI=1S/C13H11NO3/c15-8-11-12(16)7-10(14-13(11)17)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H2,14,16,17)
InChIKeyOFDKPWCCYRMWNM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus carbonarius (ncbitaxon:40993) - PubMed (17420566)
ChEBI Ontology
Outgoing Relation(s)
Carbonarone B (CHEBI:197795) is a pyridinecarbaldehyde (CHEBI:38187)
IUPAC Name 
6-benzyl-4-hydroxy-2-oxo-1H-pyridine-3-carbaldehyde
Manual XrefsDatabases
78434601ChemSpider