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CHEBI:232948 - 3-hydroxy imidacloprid

ChEBI IDCHEBI:232948
ChEBI Name3-hydroxy imidacloprid
Stars
SubmitterFlyBase
DownloadsMolfile
FormulaC28H32O6
Net Charge0
Average Mass464.558
Monoisotopic Mass464.21989
SMILES[H]/C(C(=O)C(CC1CCC1)C(=O)/C([H])=C(\[H])c1ccc(OC)c(OC)c1)=C(/[H])c1ccc(OC)c(OC)c1
InChIInChI=1S/C28H32O6/c1-31-25-14-10-20(17-27(25)33-3)8-12-23(29)22(16-19-6-5-7-19)24(30)13-9-21-11-15-26(32-2)28(18-21)34-4/h8-15,17-19,22H,5-7,16H2,1-4H3/b12-8+,13-9+
InChIKeyPJOSHEDKRPRCAE-QHKWOANTSA-N
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Roles:
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.
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
genotoxin  A role played by a chemical compound to induce direct or indirect DNA damage. Such damage can potentially lead to the formation of a malignant tumour, but DNA damage does not lead inevitably to the creation of cancerous cells.
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.
neonicotinoid insectide  A class of neuro-active insecticides that act at the nicotinic acetylcholine receptor.
Applications:
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.
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.
ChEBI Ontology
Outgoing Relation(s)
3-hydroxy imidacloprid (CHEBI:232948) has role neonicotinoid insectide (CHEBI:25540)
3-hydroxy imidacloprid (CHEBI:232948) has role nicotinic acetylcholine receptor agonist (CHEBI:47958)
3-hydroxy imidacloprid (CHEBI:232948) is a imidacloprid (CHEBI:5870)
IUPAC Name 
N-[1-[(6-chloro-5-hydroxypyridin-3-yl)methyl]-4,5-dihydroimidazol-2-yl]nitramide
Synonyms  Source
imidacloprid-3-hydroxySUBMITTER
5-hydroxy-imidaclopridSUBMITTER
Citations