CHEBI:147360 - (S)-imazaquin

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ChEBI Name (S)-imazaquin ChEBI ID CHEBI:147360 ChEBI ASCII Name (S)-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 S-configuration. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search 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-/m0/s1 InChIKey CABMTIJINOIHOD-KRWDZBQOSA-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 ) View more via ChEBI Ontology ChEBI Ontology Outgoing (S)-imazaquin (CHEBI:147360) is a 2-[4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid (CHEBI:147361) (S)-imazaquin (CHEBI:147360) is conjugate acid of (S)-imazaquin(1−) (CHEBI:147374) (S)-imazaquin (CHEBI:147360) is enantiomer of (R)-imazaquin (CHEBI:147359) Incoming imazaquin (CHEBI:5869) has part (S)-imazaquin (CHEBI:147360) (S)-imazaquin(1−) (CHEBI:147374) is conjugate base of (S)-imazaquin (CHEBI:147360) (R)-imazaquin (CHEBI:147359) is enantiomer of (S)-imazaquin (CHEBI:147360) IUPAC Name 2-[(4S)-4-methyl-5-oxo-4-(propan-2-yl)-4,5-dihydro-1H-imidazol-2-yl]quinoline-3-carboxylic acid Synonym Source S-imazaquin ChEBI Registry Number Type Source 355841-30-4 CAS Registry Number ChEBI Last Modified 02 April 2020