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CHEBI:67898 - orsellinic acid methyl ester

ChEBI IDCHEBI:67898
ChEBI Nameorsellinic acid methyl ester
Stars
DefinitionA natural product found in Rhododendron ferrugineum.
Last Modified22 September 2014
DownloadsMolfile
FormulaC9H10O4
Net Charge0
Average Mass182.175
Monoisotopic Mass182.05791
SMILESCOC(=O)c1c(C)cc(O)cc1O
InChIInChI=1S/C9H10O4/c1-5-3-6(10)4-7(11)8(5)9(12)13-2/h3-4,10-11H,1-2H3
InChIKeyNCCWCZLEACWJIN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rhododendron ferrugineum (ncbitaxon:49622) leaf (BTO:0000713) PubMed (21443171) MeOH extract of CHCl3 soluble fraction of air-dried, powdered leaves
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
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)
orsellinic acid methyl ester (CHEBI:67898) has role metabolite (CHEBI:25212)
orsellinic acid methyl ester (CHEBI:67898) is a hydroxybenzoic acid (CHEBI:24676)
Synonyms  Source
Benzoic acid, 2,4-dihydroxy-6-methyl-, methyl esterChEBI
Methyl 4,6-dihydroxy-2-methylbenzoateChEBI
Citations