| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:57 UTC |
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| Update Date | 2025-03-21 18:01:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00031220 |
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| Frequency | 118.3 |
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| Structure | |
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| Chemical Formula | C12H6BrCl3O |
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| Molecular Mass | 349.8668 |
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| SMILES | Clc1ccc(Oc2ccc(Cl)cc2Br)c(Cl)c1 |
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| InChI Key | PKJWZTWGVHVRJL-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 chloridesbromobenzenesdiarylethersdichlorobenzeneshydrocarbon derivativesorganobromidesorganochloridesphenol ethersphenoxy compounds |
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| Substituents | aryl chloridechlorobenzenediaryl etherphenol etheretherorganochloridebromodiphenyl etherbromobenzeneorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compoundorganic oxygen compoundorganobromidehydrocarbon derivativehalobenzenephenoxy compoundaryl bromideorganooxygen compound |
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