CHEBI:39115 - (+)-trans-(S)-allethrin

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ChEBI Name (+)-trans-(S)-allethrin
ChEBI ID CHEBI:39115
ChEBI ASCII Name (+)-trans-(S)-allethrin
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H26O3
Net Charge 0
Average Mass 302.40794
Monoisotopic Mass 302.188
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+/m1/s1
InChIKey ZCVAOQKBXKSDMS-PVAVHDDUSA-N
SMILES CC(C)=C[C@@H]1[C@@H](C(=O)O[C@H]2CC(=O)C(CC=C)=C2C)C1(C)C
Roles Classification
Biological Role(s): pyrethroid ester insecticide

(via allethrin )
Application(s): pyrethroid ester insecticide

(via allethrin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (+)-trans-(S)-allethrin (CHEBI:39115) is a (+)-trans-allethrin (CHEBI:39118)
(+)-trans-(S)-allethrin (CHEBI:39115) is enantiomer of (−)-trans-(R)-allethrin (CHEBI:39121)
Incoming (−)-trans-(R)-allethrin (CHEBI:39121) is enantiomer of (+)-trans-(S)-allethrin (CHEBI:39115)
IUPAC Name
(1S)-2-methyl-4-oxo-3-(prop-2-en-1-yl)cyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate
Synonyms Sources
(1S)-3-allyl-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropanecarboxylate IUPAC
(S)-3-allyl-3-methyl-4-oxocyclopent-2-enyl (+)-trans-chrysanthemate ChemIDplus
bioallethrin S-cyclopentenyl ChEBI
bioallethrin S-cyclopentenyl isomer ChEBI
S-bioallethrin ChemIDplus
trans-(+)-allethrin ChemIDplus
Manual Xref Database
4354 DrugCentral
View more database links
Registry Numbers Types Sources
2059862 Beilstein Registry Number ChemIDplus
28434-00-6 CAS Registry Number ChemIDplus
Last Modified
22 February 2017