spiromesifen (CHEBI:38640)

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ChEBI Name	spiromesifen

ChEBI ID	CHEBI:38640

Definition	A butenolide that is but-2-en-4-olide bearing a 2,4,6-trimethylphenyl group at position 3, a 3,3-dimethylbutyryloxy group at position 4 and a spiro-fused cyclopentyl ring at position 5.

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

Supplier Information

Download	Molfile XML SDF

Formula

C23H30O4

Net Charge

Average Mass

370.48190

Monoisotopic Mass

370.21441

InChI

InChI=1S/C23H30O4/c1-14-11-15(2)18(16(3)12-14)19-20(26-17(24)13-22(4,5)6)23(27-21(19)25)9-7-8-10-23/h11-12H,7-10,13H2,1-6H3

InChIKey

GOLXNESZZPUPJE-UHFFFAOYSA-N

SMILES

Cc1cc(C)c(c(C)c1)C1=C(OC(=O)CC(C)(C)C)C2(CCCC2)OC1=O

Roles Classification
Application(s):	insecticide Strictly, a substance intended to kill members of the class Insecta. In common usage, any substance used for preventing, destroying, repelling or controlling insects.

ChEBI Ontology
Outgoing	spiromesifen (CHEBI:38640) has functional parent 1,3,5-trimethylbenzene (CHEBI:34833) spiromesifen (CHEBI:38640) has functional parent 3,3-dimethylbutyric acid (CHEBI:38647) spiromesifen (CHEBI:38640) has role insecticide (CHEBI:24852) spiromesifen (CHEBI:38640) is a butenolide (CHEBI:50523)

IUPAC Name

2-oxo-3-(2,4,6-trimethylphenyl)-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate

Synonyms	Sources
3-mesityl-2-oxo-1-oxaspiro[4.4]non-3-en-4-yl 3,3-dimethylbutanoate	IUPAC
spiromesifen	ChemIDplus

Last Modified

28 July 2014