antrocapmphin A (CHEBI:65414)

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ChEBI Name	antrocapmphin A

ChEBI ID	CHEBI:65414

Definition	A methoxybenzene that is 1,2,5-trimethoxy-3-methylbenzene substituted by a 3-methylbut-3-en-1-yn-1-yl group at position 4. It is isolated from Antrodia camphorata and exhibits anti-inflammatory activity.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C15H18O3

Net Charge

Average Mass

246.30160

Monoisotopic Mass

246.12559

InChI

InChI=1S/C15H18O3/c1-10(2)7-8-12-11(3)15(18-6)14(17-5)9-13(12)16-4/h9H,1H2,2-6H3

InChIKey

CPPLWBNAWKMJON-UHFFFAOYSA-N

SMILES

COc1cc(OC)c(C#CC(C)=C)c(C)c1OC

Metabolite of Species	Details
Taiwanofungus camphoratus (NCBI:txid196114)	Parasitic fungi on fruiting body of Cinnamomum kanehirai See: PubMed

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.

Application(s):	anti-inflammatory agent Any compound that has anti-inflammatory effects.

ChEBI Ontology
Outgoing	antrocapmphin A (CHEBI:65414) has role anti-inflammatory agent (CHEBI:67079) antrocapmphin A (CHEBI:65414) has role metabolite (CHEBI:25212) antrocapmphin A (CHEBI:65414) is a methoxybenzenes (CHEBI:51683)

IUPAC Name

1,2,5-trimethoxy-3-methyl-4-(3-methylbut-3-en-1-yn-1-yl)benzene

Registry Number	Type	Source
11184575	Reaxys Registry Number	Reaxys

Last Modified

23 November 2012