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CHEBI:83483 - metazachlor OXA
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ChEBI Name
metazachlor OXA
ChEBI ID
CHEBI:83483
Definition
A monocarboxylic acid that is oxoacetic acid substituted by a (2,6-dimethylphenyl)(1
H
-pyrazol-1-ylmethyl)amino group at position 2. It is metabolite of the herbicide metazachlor.
Stars
This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C14H15N3O3
Net Charge
0
Average Mass
273.28720
Monoisotopic Mass
273.11134
InChI
InChI=1S/C14H15N3O3/c1-
10-
5-
3-
6-
11(2)
12(10)
17(13(18)
14(19)
20)
9-
16-
8-
4-
7-
15-
16/h3-
8H,9H2,1-
2H3,(H,19,20)
InChIKey
PHMHHVKFXZNTKU-UHFFFAOYSA-N
SMILES
Cc1cccc(C)c1N(Cn1cccn1)C(=O)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted 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
metazachlor OXA (
CHEBI:83483
)
has role
marine xenobiotic metabolite (
CHEBI:83399
)
metazachlor OXA (
CHEBI:83483
)
is a
aromatic amide (
CHEBI:62733
)
metazachlor OXA (
CHEBI:83483
)
is a
monocarboxylic acid (
CHEBI:25384
)
metazachlor OXA (
CHEBI:83483
)
is a
pyrazoles (
CHEBI:26410
)
IUPAC Name
[(2,6-dimethylphenyl)(1
H
-pyrazol-1-ylmethyl)amino](oxo)acetic acid
Last Modified
12 November 2014