| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:32 UTC |
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| Update Date | 2025-03-21 18:05:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058686 |
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| Frequency | 53.8 |
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| Structure | |
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| Chemical Formula | C12H7Br3O2 |
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| Molecular Mass | 419.7996 |
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| SMILES | Oc1ccc(Br)cc1Oc1ccc(Br)cc1Br |
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| InChI Key | IJILTEHAPUZZFY-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 | diphenylethers |
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| Direct Parent | bromodiphenyl ethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsaryl bromidesbromobenzenesdiarylethershalophenolshydrocarbon derivativesorganobromidesp-bromophenolsphenol ethersphenoxy compounds |
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| Substituents | diaryl etherphenol etherether4-bromophenolbromodiphenyl ether1-hydroxy-2-unsubstituted benzenoidbromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compound4-halophenolorganic oxygen compoundorganobromidephenolhydrocarbon derivativehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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