| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 00:12:12 UTC |
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| Update Date | 2025-03-21 18:32:31 UTC |
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| HMDB ID | HMDB0256169 |
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| Metabolite Identification |
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| DeepMet ID | DMID00091247 |
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| Name | 2,2',4,4',5-Pentachlorodiphenyl ether |
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| Frequency | 30.8 |
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| Structure | |
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| Chemical Formula | C12H5Cl5O |
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| Molecular Mass | 339.8783 |
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| SMILES | Clc1ccc(Oc2cc(Cl)c(Cl)cc2Cl)c(Cl)c1 |
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| InChI Key | AVURWLKSFZBANQ-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 | diphenylethers |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chloridesdiarylethersdichlorobenzeneshydrocarbon derivativesorganochloridesphenol ethersphenoxy compounds |
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| Substituents | aryl chloridechlorobenzenediaryl etherphenol etheretherorganochlorideorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compoundorganic oxygen compoundhydrocarbon derivativehalobenzenephenoxy compounddiphenyletherorganooxygen compound |
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