| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:17 UTC |
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| Update Date | 2025-03-21 18:05:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058099 |
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| Frequency | 54.5 |
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| Structure | |
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| Chemical Formula | C7H5BrO3 |
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| Molecular Mass | 215.9422 |
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| SMILES | O=C(O)c1ccc(Br)cc1O |
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| InChI Key | FYAKLZKQJDBBKW-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 | benzoic acids and derivatives |
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| Direct Parent | salicylic acids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-carboxy-2-haloaromatic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids4-halobenzoic acidsaryl bromidesbenzoic acidsbenzoyl derivativesbromobenzeneshalobenzoic acidshalophenolshydrocarbon derivativesm-bromophenolsmonocarboxylic acids and derivativesorganic oxidesorganobromidesorganooxygen compoundsvinylogous acids |
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| Substituents | carboxylic acidbenzoyl1-hydroxy-2-unsubstituted benzenoidsalicylic acidcarboxylic acid derivativeorganohalogen compoundorganic oxide3-bromophenol1-carboxy-2-haloaromatic compoundbenzoic acid3-halophenolhalobenzoic acid4-halobenzoic acidbromobenzenehalobenzoic acid or derivatives1-hydroxy-4-unsubstituted benzenoidaryl halide4-halobenzoic acid or derivativesaromatic homomonocyclic compoundvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundorganobromidephenolhydrocarbon derivativehalobenzenearyl bromideorganooxygen compound |
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