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CHEBI:64413 - diorcinol

Default Structure
ChEBI IDCHEBI:64413
ChEBI Namediorcinol
Stars
DefinitionAn aromatic ether that is diphenyl ether in which both phenyl groups are substituted at position 3 by a hydroxy group and at position 5 by a methyl group.
Last Modified6 June 2022
SubmitterGareth Owen
DownloadsMolfile
FormulaC14H14O3
Net Charge0
Average Mass230.263
Monoisotopic Mass230.09429
SMILESCc1cc(O)cc(Oc2cc(C)cc(O)c2)c1
InChIInChI=1S/C14H14O3/c1-9-3-11(15)7-13(5-9)17-14-6-10(2)4-12(16)8-14/h3-8,15-16H,1-2H3
InChIKeySPCJQQBYWVGMQG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ascomycota sp. Ind19F07 (ncbitaxon:1583058) - PubMed (25537370)
Roles Classification
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
diorcinol (CHEBI:64413) has role fungal metabolite (CHEBI:76946)
diorcinol (CHEBI:64413) has role marine metabolite (CHEBI:76507)
diorcinol (CHEBI:64413) has role metabolite (CHEBI:25212)
diorcinol (CHEBI:64413) is a aromatic ether (CHEBI:35618)
diorcinol (CHEBI:64413) is a phenols (CHEBI:33853)
IUPAC Name 
3,3'-oxybis(5-methylphenol)
Synonym  Source
3,3'-dihydroxy-5,5'-dimethyldiphenyl etherChEBI
Registry NumbersSources
Reaxys:2272621Reaxys
Citations