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CHEBI:71593 - filicinic acid

ChEBI IDCHEBI:71593
ChEBI Namefilicinic acid
Stars
DefinitionAn enone that is cyclohexa-2,5-dien-1-one substituted by hydroxy groups at positions 3 and 5 and geminal methyl groups at position 4.
Last Modified15 January 2013
Submitternamrata
DownloadsMolfile
FormulaC8H10O3
Net Charge0
Average Mass154.165
Monoisotopic Mass154.06299
SMILESCC1(C)C(O)=CC(=O)C=C1O
InChIInChI=1S/C8H10O3/c1-8(2)6(10)3-5(9)4-7(8)11/h3-4,10-11H,1-2H3
InChIKeyZITLVRQXJUFZOO-UHFFFAOYSA-N
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)
filicinic acid (CHEBI:71593) has functional parent phloroglucinol (CHEBI:16204)
filicinic acid (CHEBI:71593) has role metabolite (CHEBI:25212)
filicinic acid (CHEBI:71593) is a enol (CHEBI:33823)
filicinic acid (CHEBI:71593) is a enone (CHEBI:51689)
Incoming Relation(s)
drummondin D (CHEBI:65809) has functional parent filicinic acid (CHEBI:71593)
drummondin E (CHEBI:65810) has functional parent filicinic acid (CHEBI:71593)
drummondin F (CHEBI:65811) has functional parent filicinic acid (CHEBI:71593)
isodrummondin D (CHEBI:65812) has functional parent filicinic acid (CHEBI:71593)
IUPAC Name 
3,5-dihydroxy-4,4-dimethylcyclohexa-2,5-dien-1-one
Registry NumbersSources
Reaxys:2046871Reaxys
CAS:2065-00-1ChemIDplus
Citations