p-menth-4(8)-en-3-one (CHEBI:26381)

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ChEBI Name	p-menth-4(8)-en-3-one

ChEBI ID	CHEBI:26381

ChEBI ASCII Name	p-menth-4(8)-en-3-one

Definition	A p-menthane monoterpenoid that is cyclohexan-1-one substituted by a methyl group at position 5 and a propan-2-ylidene group at position 2.

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

Supplier Information

Download	Molfile XML SDF

Formula

C10H16O

Net Charge

Average Mass

152.23344

Monoisotopic Mass

152.12012

InChI

InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h8H,4-6H2,1-3H3

InChIKey

NZGWDASTMWDZIW-UHFFFAOYSA-N

SMILES

CC1CCC(C(=O)C1)=C(C)C

Roles Classification
Biological Role(s):	volatile oil component Any plant metabolite that is found naturally as a component of a volatile oil. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	p-menth-4(8)-en-3-one (CHEBI:26381) has role plant metabolite (CHEBI:76924) p-menth-4(8)-en-3-one (CHEBI:26381) has role volatile oil component (CHEBI:27311) p-menth-4(8)-en-3-one (CHEBI:26381) is a p-menthane monoterpenoid (CHEBI:25186) p-menth-4(8)-en-3-one (CHEBI:26381) is a enone (CHEBI:51689)

Incoming	(+)-pulegone (CHEBI:35596) is a p-menth-4(8)-en-3-one (CHEBI:26381)

IUPAC Names

5-methyl-2-(propan-2-ylidene)cyclohexan-1-one

p-menth-4(8)-en-3-one

Synonyms	Sources
(+-)-Pulegone	ChemIDplus
1-Isopropylidene-4-methyl-2-cyclohexanone	ChemIDplus
1-Methyl-4-isopropylidene-3-cyclohexanone	ChemIDplus
4(8)-p-Menthen-3-one	ChemIDplus
5-Methyl-2-(1-methylethylidene)cyclohexanone	ChemIDplus
5-Methyl-2-isopropylidenecyclohexanone	ChemIDplus
Pulegone	ChemIDplus

Registry Number	Type	Source
15932-80-6	CAS Registry Number	ChemIDplus

Citation	Type	Source
24506214	PubMed citation	Europe PMC

Last Modified

12 May 2015