| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:54:10 UTC |
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| Update Date | 2025-03-25 00:51:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02188020 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H8BrNO3 |
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| Molecular Mass | 244.9688 |
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| SMILES | CC(=O)Nc1cc(O)c(O)cc1Br |
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| InChI Key | OYDFUTLMVYLMBC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | anilides |
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| Direct Parent | o-haloacetanilides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacetamidesaryl bromidesbromobenzenescarbonyl compoundscarboxylic acids and derivativeshalophenolshydrocarbon derivativesm-bromophenolsn-acetylarylaminesorganic oxidesorganobromidesorganopnictogen compoundsp-bromophenolssecondary carboxylic acid amides |
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| Substituents | carbonyl groupn-acetylarylamineo-haloacetanilide1-hydroxy-2-unsubstituted benzenoidn-arylamidecarboxylic acid derivativeorganohalogen compoundorganic oxide4-halophenolorganonitrogen compoundorganopnictogen compound3-bromophenolacetamide3-halophenol4-bromophenolbromobenzenecarboxamide grouparyl halidearomatic homomonocyclic compoundsecondary carboxylic acid amideorganic oxygen compoundorganobromidephenolhydrocarbon derivativeorganic nitrogen compoundhalobenzenearyl bromideorganooxygen compound |
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