| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:03:21 UTC |
|---|
| Update Date | 2025-03-21 18:28:10 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00070179 |
|---|
| Frequency | 42.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H8BrNO2 |
|---|
| Molecular Mass | 228.9738 |
|---|
| SMILES | CC(=O)Nc1ccc(Br)cc1O |
|---|
| InChI Key | NGWQORXGFYPCDR-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | benzene and substituted derivatives |
|---|
| Subclass | anilides |
|---|
| Direct Parent | p-haloacetanilides |
|---|
| Geometric Descriptor | aromatic homomonocyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsacetamidesaryl bromidesbromobenzenescarbonyl compoundscarboxylic acids and derivativeshalophenolshydrocarbon derivativesm-bromophenolsn-acetylarylaminesorganic oxidesorganobromidesorganopnictogen compoundssecondary carboxylic acid amides |
|---|
| Substituents | carbonyl groupn-acetylarylamine1-hydroxy-2-unsubstituted benzenoidn-arylamidecarboxylic acid derivativeorganohalogen compoundorganic oxideorganonitrogen compoundorganopnictogen compound3-bromophenolacetamide3-halophenolp-haloacetanilidebromobenzene1-hydroxy-4-unsubstituted benzenoidcarboxamide grouparyl halidearomatic homomonocyclic compoundsecondary carboxylic acid amideorganic oxygen compoundorganobromidephenolhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideorganooxygen compound |
|---|
