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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:39346 - esfenvalerate
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ChEBI Ontology
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ChEBI Name
esfenvalerate
ChEBI ID
CHEBI:39346
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C25H22ClNO3
Net Charge
0
Average Mass
419.89982
Monoisotopic Mass
419.12882
InChI
InChI=1S/C25H22ClNO3/c1-
17(2)
24(18-
11-
13-
20(26)
14-
12-
18)
25(28)
30-
23(16-
27)
19-
7-
6-
10-
22(15-
19)
29-
21-
8-
4-
3-
5-
9-
21/h3-
15,17,23-
24H,1-
2H3/t23-
,24+/m1/s1
InChIKey
NYPJDWWKZLNGGM-RPWUZVMVSA-N
SMILES
CC(C)[C@H](C(=O)O[C@H](C#N)c1cccc(Oc2ccccc2)c1)c1ccc(Cl)cc1
Roles Classification
Biological Role
(s):
pyrethroid ester insecticide
(via
fenvalerate
)
Application
(s):
pyrethroid ester insecticide
(via
fenvalerate
)
agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
pyrethroid ester acaricide
(via
fenvalerate
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
esfenvalerate (
CHEBI:39346
)
has role
agrochemical (
CHEBI:33286
)
esfenvalerate (
CHEBI:39346
)
has role
pyrethroid ester insecticide (
CHEBI:39116
)
esfenvalerate (
CHEBI:39346
)
is a
fenvalerate (
CHEBI:5014
)
IUPAC Name
(
S
)-cyano(3-phenoxyphenyl)methyl (2
S
)-2-(4-chlorophenyl)-3-methylbutanoate
Synonym
Source
Fenvalerate (S,S)-isomer
ChemIDplus
Manual Xrefs
Databases
269
PPDB
C18147
KEGG COMPOUND
View more database links
Registry Numbers
Types
Sources
4275674
Beilstein Registry Number
Beilstein
66230-04-4
CAS Registry Number
KEGG COMPOUND
66230-04-4
CAS Registry Number
ChemIDplus
Last Modified
28 July 2014