(-)-trans-(S)-allethrin (CHEBI:39122)

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CHEBI:39122 - (−)-trans-(S)-allethrin

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ChEBI ID	CHEBI:39122
ChEBI Name	(−)-trans-(S)-allethrin
Stars
ASCII Name	(-)-trans-(S)-allethrin
Last Modified	9 August 2007
Submitter	Kirill Degtyarenko
Downloads	Molfile

Formula	C19H26O3
Net Charge	0
Average Mass	302.414
Monoisotopic Mass	302.18819
SMILES	C=CCC1=C(C)[C@@H](OC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)CC1=O
InChI	InChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3/t14-,16-,17+/m0/s1
InChIKey	ZCVAOQKBXKSDMS-BHYGNILZSA-N

Roles Classification

Biological Role:	pyrethroid ester insecticide
Application:	pyrethroid ester insecticide

ChEBI Ontology

Outgoing Relation(s)
	(−)-trans-(S)-allethrin (CHEBI:39122) is a (−)-trans-allethrin (CHEBI:39120)
	(−)-trans-(S)-allethrin (CHEBI:39122) is enantiomer of (+)-trans-(R)-allethrin (CHEBI:39119)
Incoming Relation(s)
	(+)-trans-(R)-allethrin (CHEBI:39119) is enantiomer of (−)-trans-(S)-allethrin (CHEBI:39122)

IUPAC Name
(1S)-2-methyl-4-oxo-3-(prop-2-en-1-yl)cyclopent-2-en-1-yl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate

Synonym	Source
(1S)-3-allyl-2-methyl-4-oxocyclopent-2-en-1-yl (1S,3S)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate	IUPAC

Registry Numbers	Sources
Beilstein:3214673	Beilstein