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InChI=1S/CH4O/c1-2/h2H,1H3
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> Main
CHEBI:82034 - propaquizafop
Main
ChEBI Ontology
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ChEBI Name
propaquizafop
ChEBI ID
CHEBI:82034
Definition
A quinoxaline derivative used as systemic herbicide for annual and perennial grasses.
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Molfile
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Molfile
Formula
C22H22ClN3O5
Net Charge
0
Average Mass
443.88000
Monoisotopic Mass
443.12480
InChI
InChI=1S/C22H22ClN3O5/c1-
14(2)
26-
29-
11-
10-
28-
22(27)
15(3)
30-
17-
5-
7-
18(8-
6-
17)
31-
21-
13-
24-
20-
12-
16(23)
4-
9-
19(20)
25-
21/h4-
9,12-
13,15H,10-
11H2,1-
3H3/t15-
/m1/s1
InChIKey
FROBCXTULYFHEJ-OAHLLOKOSA-N
SMILES
C[C@@H](Oc1ccc(Oc2cnc3cc(Cl)ccc3n2)cc1)C(=O)OCCON=C(C)C
Roles Classification
Chemical Role
(s):
environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role
(s):
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):
agrochemical
An agrochemical is a substance that is used in agriculture or horticulture.
phenoxy herbicide
Any member of the class of herbicides whose members contain a phenoxy or substituted phenoxy group.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
propaquizafop (
CHEBI:82034
)
has role
agrochemical (
CHEBI:33286
)
propaquizafop (
CHEBI:82034
)
has role
environmental contaminant (
CHEBI:78298
)
propaquizafop (
CHEBI:82034
)
has role
phenoxy herbicide (
CHEBI:60575
)
propaquizafop (
CHEBI:82034
)
has role
xenobiotic (
CHEBI:35703
)
propaquizafop (
CHEBI:82034
)
is a
aromatic ether (
CHEBI:35618
)
propaquizafop (
CHEBI:82034
)
is a
carboxylic ester (
CHEBI:33308
)
propaquizafop (
CHEBI:82034
)
is a
organochlorine compound (
CHEBI:36683
)
propaquizafop (
CHEBI:82034
)
is a
oxime
O
-ether (
CHEBI:36816
)
propaquizafop (
CHEBI:82034
)
is a
quinoxaline derivative (
CHEBI:38771
)
IUPAC Name
2-
[(propan-
2-
ylideneamino)oxy]ethyl (2
R
)-
2-
{4-
[(6-
chloroquinoxalin-
2-
yl)oxy]phenoxy}propanoate
Synonyms
Sources
2-
[[(1-
methylethylidene)amino]oxy]ethyl (2
R
)-
2-
[4-
[(6-
chloro-
2-
quinoxalinyl)oxy]phenoxy]propanoate
Alan Wood's Pesticides
2-isopropylideneaminooxyethyl (
R
)-2-[4-(6-chloroquinoxalin-2-yloxy)phenoxy]propionate
Alan Wood's Pesticides
Manual Xrefs
Databases
546
PPDB
C18886
KEGG COMPOUND
EP2243362
Patent
EP2243363
Patent
propaquizafop
Alan Wood's Pesticides
WO2010017929
Patent
View more database links
Registry Numbers
Types
Sources
111479-05-1
CAS Registry Number
ChemIDplus
9805275
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15149135
PubMed citation
Europe PMC
IND44386841
Agricola citation
Europe PMC
IND93000118
Agricola citation
Europe PMC
Last Modified
18 November 2019