CHEBI:147359 - (R)-imazaquin

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ChEBI Name (R)-imazaquin
ChEBI ID CHEBI:147359
ChEBI ASCII Name (R)-imazaquin
Definition A 2-[4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid that has R-configuration. It is the more active enantiomer of imazaquin.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:39615
Supplier Information
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Formula C17H17N3O3
Net Charge 0
Average Mass 311.341
Monoisotopic Mass 311.12699
InChI InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)/t17-/m1/s1
InChIKey CABMTIJINOIHOD-QGZVFWFLSA-N
SMILES C=1(C(=CC=2C=CC=CC2N1)C(O)=O)C=3NC([C@@](N3)(C)C(C)C)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Application(s): herbicide
A substance used to destroy plant pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (R)-imazaquin (CHEBI:147359) has role herbicide (CHEBI:24527)
(R)-imazaquin (CHEBI:147359) is a 2-[4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid (CHEBI:147361)
(R)-imazaquin (CHEBI:147359) is conjugate acid of (R)-imazaquin(1−) (CHEBI:147373)
(R)-imazaquin (CHEBI:147359) is enantiomer of (S)-imazaquin (CHEBI:147360)
Incoming imazaquin (CHEBI:5869) has part (R)-imazaquin (CHEBI:147359)
(R)-imazaquin(1−) (CHEBI:147373) is conjugate base of (R)-imazaquin (CHEBI:147359)
(S)-imazaquin (CHEBI:147360) is enantiomer of (R)-imazaquin (CHEBI:147359)
IUPAC Name
2-[(4R)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid
Synonyms Sources
2-[(4R)-4-methyl-4-(1-methylethyl)-5-oxo-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid PDBeChem
R-imazaquin ChEBI
Manual Xrefs Databases
1IQ PDBeChem
DB04582 DrugBank
View more database links
Registry Number Type Source
246176-07-8 CAS Registry Number ChEBI
Citations Waiting for Citations Types Sources
16407096 PubMed citation Europe PMC
17607802 PubMed citation Europe PMC
30537433 PubMed citation Europe PMC
Last Modified
02 April 2020