CHEBI:71593 - filicinic acid

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ChEBI Name filicinic acid
ChEBI ID CHEBI:71593
Definition An 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.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C8H10O3
Net Charge 0
Average Mass 154.16320
Monoisotopic Mass 154.06299
InChI InChI=1S/C8H10O3/c1-8(2)6(10)3-5(9)4-7(8)11/h3-4,10-11H,1-2H3
InChIKey ZITLVRQXJUFZOO-UHFFFAOYSA-N
SMILES CC1(C)C(O)=CC(=O)C=C1O
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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ChEBI Ontology
Outgoing 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 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 Numbers Types Sources
2046871 Reaxys Registry Number Reaxys
2065-00-1 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
17401959 PubMed citation Europe PMC
Last Modified
15 January 2013