CHEBI:83451 - acetochlor OXA

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ChEBI Name acetochlor OXA
Definition A monocarboxylic acid that is oxoacetic acid substituted by a (ethoxymethyl)(2-ethyl-6-methylphenyl)amino group at position 2. It is a metabolite of acetochlor.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C14H19NO4
Net Charge 0
Average Mass 265.30500
Monoisotopic Mass 265.13141
InChI InChI=1S/C14H19NO4/c1-4-11-8-6-7-10(3)12(11)15(9-19-5-2)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)
SMILES CCOCN(C(=O)C(O)=O)c1c(C)cccc1CC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): marine xenobiotic metabolite
Any metabolite produced by metabolism of a xenobiotic compound in marine macro- and microorganisms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing acetochlor OXA (CHEBI:83451) has role marine xenobiotic metabolite (CHEBI:83399)
acetochlor OXA (CHEBI:83451) is a aromatic amide (CHEBI:62733)
acetochlor OXA (CHEBI:83451) is a ether (CHEBI:25698)
acetochlor OXA (CHEBI:83451) is a monocarboxylic acid (CHEBI:25384)
[(ethoxymethyl)(2-ethyl-6-methylphenyl)amino](oxo)acetic acid
Synonym Source
acetochlor oxanilic acid ChEBI
Registry Number Type Source
7819652 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
10805235 PubMed citation Europe PMC
15888886 PubMed citation Europe PMC
20206657 PubMed citation Europe PMC
24691721 PubMed citation Europe PMC
Last Modified
05 November 2014
General Comments
2014-10-29 Metabolite of Acetochlor
2014-10-29 Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag