zerumbone (CHEBI:63892)

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ChEBI Name	zerumbone

ChEBI ID	CHEBI:63892

Definition	A sesquiterpenoid and cyclic ketone that is (1E,4E,8E)-α-humulene which is substituted by an oxo group at the carbon atom attached to two double bonds. It is obtained by steam distillation from a type of edible ginger, Zingiber zerumbet Smith, grown particularly in southeast Asia.

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C15H22O

Net Charge

Average Mass

218.33460

Monoisotopic Mass

218.16707

InChI

InChI=1S/C15H22O/c1-12-6-5-7-13(2)14(16)9-11-15(3,4)10-8-12/h7-9,11H,5-6,10H2,1-4H3/b11-9+,12-8+,13-7+

InChIKey

GIHNTRQPEMKFKO-SKTNYSRSSA-N

SMILES

C\C1=C/CC(C)(C)\C=C\C(=O)\C(C)=C\CC1

Metabolite of Species	Details
Zingiber aromaticum (IPNI:798315-1)	Found in rhizome (BTO:0001181). See: DOI
Zingiber cassumunar (IPNI:798323-1)	Found in rhizome (BTO:0001181). See: PubMed
Zingiber zerumbet (NCBI:txid311405)	Found in rhizome (BTO:0001181). See: PubMed

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. glioma-associated oncogene inhibitor An inhibitor of any of the glioma-associated oncogene (GLI) proteins.

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

ChEBI Ontology
Outgoing	zerumbone (CHEBI:63892) has parent hydride α-humulene (CHEBI:49311) zerumbone (CHEBI:63892) has role anti-inflammatory agent (CHEBI:67079) zerumbone (CHEBI:63892) has role glioma-associated oncogene inhibitor (CHEBI:140922) zerumbone (CHEBI:63892) has role plant metabolite (CHEBI:76924) zerumbone (CHEBI:63892) is a cyclic ketone (CHEBI:3992) zerumbone (CHEBI:63892) is a sesquiterpenoid (CHEBI:26658)

Incoming	5-hydroxyzerumbone (CHEBI:66050) has functional parent zerumbone (CHEBI:63892) zerumboneoxide (CHEBI:66502) has functional parent zerumbone (CHEBI:63892)

IUPAC Name

(2E,6E,10E)-2,6,9,9-tetramethylcycloundeca-2,6,10-trien-1-one

Synonyms	Sources
(E,E,E)-2,6,9,9-tetramethyl-2,6,10-cycloundecatrien-1-one	ChemIDplus
2E,6E,9E-humulatrien-8-one	ChEBI
zerumbone	UniProt

Last Modified

01 June 2018