| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:00:22 UTC |
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| Update Date | 2025-03-21 18:06:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00063012 |
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| Frequency | 49.1 |
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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)c1cccc(Br)c1O |
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| InChI Key | BHPSQWRVKOPSOQ-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-4-unsubstituted benzenoids3-halobenzoic acidsaryl bromidesbenzoic acidsbenzoyl derivativesbromobenzeneshalobenzoic acidshalophenolshydrocarbon derivativesmonocarboxylic acids and derivativeso-bromophenolsorganic oxidesorganobromidesorganooxygen compoundsvinylogous acids |
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| Substituents | carboxylic acid3-halobenzoic acid or derivativesbenzoylsalicylic acidcarboxylic acid derivativeorganohalogen compoundorganic oxide3-halobenzoic acid1-carboxy-2-haloaromatic compoundbenzoic acid2-bromophenolhalobenzoic acidbromobenzenehalobenzoic acid or derivatives1-hydroxy-4-unsubstituted benzenoidaryl halidearomatic homomonocyclic compound2-halophenolvinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundorganobromidephenolhydrocarbon derivativehalobenzenearyl bromideorganooxygen compound |
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