| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:17 UTC |
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| Update Date | 2025-03-25 00:57:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222838 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H7BrO |
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| Molecular Mass | 197.968 |
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| SMILES | O=Cc1ccc(CBr)cc1 |
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| InChI Key | XYPVBKDHERGKJG-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 | benzyl halides |
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| Direct Parent | benzyl bromides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl bromidesbenzaldehydesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganobromidesorganooxygen compounds |
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| Substituents | benzoylaldehydeorganohalogen compoundalkyl bromidearomatic homomonocyclic compoundbenzaldehydeorganic oxidearyl-aldehydeorganic oxygen compoundorganobromidealkyl halidehydrocarbon derivativebenzyl bromideorganooxygen compound |
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