| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:08 UTC |
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| Update Date | 2025-03-25 00:47:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160469 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H8Br3NO |
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| Molecular Mass | 418.8156 |
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| SMILES | Nc1cc(Br)ccc1Oc1ccc(Br)cc1Br |
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| InChI Key | QHRUFACUMSTVPL-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 | aryl bromidesbromobenzenesdiarylethershydrocarbon derivativesorganobromidesorganopnictogen compoundsphenol ethersphenoxy compoundsprimary amines |
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| Substituents | diaryl etherphenol etheretherbromodiphenyl etherbromobenzeneorganohalogen compoundaryl halidearomatic homomonocyclic compoundorganic oxygen compoundorganonitrogen compoundorganobromideorganopnictogen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundhalobenzenephenoxy compoundaryl bromideamineorganooxygen compound |
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