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> Main
CHEBI:39178 - clothianidin
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ChEBI Name
clothianidin
ChEBI ID
CHEBI:39178
Definition
An
N
-nitro compound consisting of 2-nitroguanidine having a (2-chloro-1,3-thiazol-5-yl)methyl group at position 1 and a methyl group at position 3.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C6H8ClN5O2S
Net Charge
0
Average Mass
249.67800
Monoisotopic Mass
249.00872
InChI
InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)
InChIKey
PGOOBECODWQEAB-UHFFFAOYSA-N
SMILES
CNC(NCc1cnc(Cl)s1)=N[N+]([O-])=O
Roles Classification
Chemical Role
(s):
environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role
(s):
nicotinic acetylcholine receptor agonist
An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
neonicotinoid insectide
A class of neuro-active insecticides that act at the nicotinic acetylcholine receptor.
xenobiotic
A xenobiotic (Greek,
xenos
"foreign";
bios
"life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application
(s):
nicotinic acetylcholine receptor agonist
An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
neonicotinoid insectide
A class of neuro-active insecticides that act at the nicotinic acetylcholine receptor.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
clothianidin (
CHEBI:39178
)
has functional parent
2-chlorothiazole (
CHEBI:39187
)
clothianidin (
CHEBI:39178
)
has functional parent
2-nitroguanidine (
CHEBI:39181
)
clothianidin (
CHEBI:39178
)
has role
environmental contaminant (
CHEBI:78298
)
clothianidin (
CHEBI:39178
)
has role
neonicotinoid insectide (
CHEBI:25540
)
clothianidin (
CHEBI:39178
)
has role
nicotinic acetylcholine receptor agonist (
CHEBI:47958
)
clothianidin (
CHEBI:39178
)
has role
xenobiotic (
CHEBI:35703
)
clothianidin (
CHEBI:39178
)
is a
1,3-thiazoles (
CHEBI:38418
)
clothianidin (
CHEBI:39178
)
is a
2-nitroguanidine derivative (
CHEBI:84773
)
clothianidin (
CHEBI:39178
)
is a
organochlorine compound (
CHEBI:36683
)
Incoming
(
E
)-clothianidin (
CHEBI:39177
)
is a
clothianidin (
CHEBI:39178
)
IUPAC Name
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-3-methyl-2-nitroguanidine
Synonym
Source
CLO
ChEBI
Manual Xrefs
Databases
C18508
KEGG COMPOUND
clothianidin
Alan Wood's Pesticides
Clothianidin
Wikipedia
CT4
PDBeChem
View more database links
Registry Number
Type
Source
9196326
Reaxys Registry Number
Reaxys
Citations
Types
Sources
19583978
PubMed citation
Europe PMC
20824681
PubMed citation
Europe PMC
20873771
PubMed citation
Europe PMC
21404859
PubMed citation
Europe PMC
21510196
PubMed citation
Europe PMC
21538459
PubMed citation
Europe PMC
22025502
PubMed citation
Europe PMC
22076810
PubMed citation
Europe PMC
22083888
PubMed citation
Europe PMC
22235278
PubMed citation
Europe PMC
22253863
PubMed citation
Europe PMC
22286500
PubMed citation
Europe PMC
22290809
PubMed citation
Europe PMC
22311678
PubMed citation
Europe PMC
22431174
PubMed citation
Europe PMC
22459421
PubMed citation
Europe PMC
25828917
PubMed citation
Europe PMC
25835428
PubMed citation
Europe PMC
25839080
PubMed citation
Europe PMC
Last Modified
28 April 2015
General Comment
2014-10-29
Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag