| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:39:55 UTC |
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| Update Date | 2025-03-21 17:58:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00015238 |
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| Frequency | 286.0 |
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| Structure | |
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| Chemical Formula | C12H6Br3IO |
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| Molecular Mass | 529.7013 |
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| SMILES | Brc1ccc(Oc2ccc(I)cc2Br)c(Br)c1 |
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| InChI Key | PMLLZCZVDUMITE-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 bromidesaryl iodidesbromobenzenesdiarylethershydrocarbon derivativesiodobenzenesorganobromidesorganoiodidesphenol ethersphenoxy compounds |
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| Substituents | diaryl etherphenol etheretherbromodiphenyl etherbromobenzeneorganohalogen compoundiodobenzeneorganoiodidearyl halidearomatic homomonocyclic compoundorganic oxygen compoundorganobromidehydrocarbon derivativearyl iodidehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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