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CHEBI:1606 - 1-methyl-4-imidazoleacetic acid
| Formula | C6H8N2O2 |
| Net Charge | 0 |
| Average Mass | 140.142 |
| Monoisotopic Mass | 140.05858 |
| SMILES | Cn1cnc(CC(=O)O)c1 |
| InChI | InChI=1S/C6H8N2O2/c1-8-3-5(7-4-8)2-6(9)10/h3-4H,2H2,1H3,(H,9,10) |
| InChIKey | ZHCKPJGJQOPTLB-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Roles: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. GABA agonist A drug that binds to and activates γ-aminobutyric acid receptors. |
| Application: | GABA agonist A drug that binds to and activates γ-aminobutyric acid receptors. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) has functional parent acetic acid (CHEBI:15366) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) has role GABA agonist (CHEBI:51373) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) has role metabolite (CHEBI:25212) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) is a imidazoles (CHEBI:24780) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) is a monocarboxylic acid (CHEBI:25384) |
| 1-methyl-4-imidazoleacetic acid (CHEBI:1606) is conjugate acid of 1-methyl-4-imidazoleacetate (CHEBI:132918) |
| Incoming Relation(s) |
| 1-methyl-4-imidazoleacetate (CHEBI:132918) is conjugate base of 1-methyl-4-imidazoleacetic acid (CHEBI:1606) |
| IUPAC Name |
|---|
| (1-methyl-1H-imidazol-4-yl)acetic acid |
| Synonyms | Source |
|---|---|
| 1,4-methyl-imidazoleacetic acid | HMDB |
| 1-Methylimidazole-4-acetate | KEGG COMPOUND |
| Methylimidazoleacetate | KEGG COMPOUND |
| Methylimidazoleacetic acid | KEGG COMPOUND |
| Tele-methylimidazoleacetic acid | KEGG COMPOUND |
| Manual Xrefs | Databases |
|---|---|
| C05828 | KEGG COMPOUND |
| HMDB0002820 | HMDB |
| Registry Numbers | Sources |
|---|---|
| Reaxys:126895 | Reaxys |
| CAS:2625-49-2 | ChemIDplus |
| CAS:2625-49-2 | KEGG COMPOUND |
| Citations |
|---|