| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:55 UTC |
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| Update Date | 2025-03-25 01:01:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251503 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H7Cl3O |
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| Molecular Mass | 271.9562 |
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| SMILES | Oc1c(Cl)cc(Cl)cc1-c1ccc(Cl)cc1 |
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| InChI Key | GJWIPOLKTCFKGR-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 | biphenyls and derivatives |
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| Direct Parent | polychlorinated biphenyls |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl chloridesdichlorobenzeneshalophenolshydrocarbon derivativeso-chlorophenolsorganochloridesorganooxygen compoundsp-chlorophenols |
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| Substituents | aryl chloride2-chlorophenolchlorobenzene4-chlorophenolorganochloridepolychlorinated biphenylorganohalogen compoundaryl halide1,3-dichlorobenzenearomatic homomonocyclic compound2-halophenol4-halophenolorganic oxygen compoundphenolhydrocarbon derivativehalobenzeneorganooxygen compound |
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