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CHEBI:69581 - Paeonol

ChEBI IDCHEBI:69581
ChEBI NamePaeonol
Stars
DefinitionA natural product found in Paeonia rockii subspecies rockii.
Secondary ChEBI IDCHEBI:7890
Last Modified25 February 2016
DownloadsMolfile
FormulaC9H10O3
Net Charge0
Average Mass166.176
Monoisotopic Mass166.06299
SMILESCOc1ccc(C(C)=O)c(O)c1
InChIInChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
InChIKeyUILPJVPSNHJFIK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Paeonia rockii subsp. rockii (ncbitaxon:459179) root (BTO:0001188) PubMed (21954959) Isolated from chloroform soluble extract of air-dried and powdered roots
Brassica napus (ncbitaxon:3708) - MetaboLights (MTBLS309) From MetaboLights
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Paeonol (CHEBI:69581) has role metabolite (CHEBI:25212)
Paeonol (CHEBI:69581) is a methoxybenzenes (CHEBI:51683)
Paeonol (CHEBI:69581) is a phenols (CHEBI:33853)
Synonyms  Source
PaeonolKEGG COMPOUND
1-(2-Hydroxy-4-methoxyphenyl)ethanoneChEBI
4-O-MethylresacetophenoneChEBI
Manual XrefsDatabases
C10712KEGG COMPOUND
C00002704KNApSAcK
LSM-24937LINCS
Registry NumbersSources
CAS:552-41-0KEGG COMPOUND
CAS:552-41-0ChemIDplus
Citations