menthofuran (CHEBI:50542)

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ChEBI Name	menthofuran

ChEBI ID	CHEBI:50542

Definition	A monoterpenoid that is 4,5,6,7-tetrahydro-1-benzofuran substituted by methyl groups at positions 3 and 6.

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

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Formula

C10H14O

Net Charge

Average Mass

150.21760

Monoisotopic Mass

150.10447

InChI

InChI=1S/C10H14O/c1-7-3-4-9-8(2)6-11-10(9)5-7/h6-7H,3-5H2,1-2H3

InChIKey

YGWKXXYGDYYFJU-UHFFFAOYSA-N

SMILES

CC1CCc2c(C)coc2C1

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.

Application(s):	nematicide A substance used to destroy pests of the phylum Nematoda (roundworms).

ChEBI Ontology
Outgoing	menthofuran (CHEBI:50542) has role nematicide (CHEBI:25491) menthofuran (CHEBI:50542) has role plant metabolite (CHEBI:76924) menthofuran (CHEBI:50542) is a 1-benzofurans (CHEBI:38830) menthofuran (CHEBI:50542) is a monoterpenoid (CHEBI:25409)

Incoming	(−)-menthofuran (CHEBI:50544) is a menthofuran (CHEBI:50542) (+)-menthofuran (CHEBI:6750) is a menthofuran (CHEBI:50542)

IUPAC Name

3,6-dimethyl-4,5,6,7-tetrahydro-1-benzofuran

Synonyms	Sources
3,9-epoxy-p-mentha-3,8-diene	NIST Chemistry WebBook
4,5,6,7-tetrahydro-3,6-dimethylbenzofuran	ChemIDplus
4,5,6,7-tetrahydro-3,6-dimethylcoumarone	ChemIDplus

Last Modified

23 October 2015