| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:09:13 UTC |
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| Update Date | 2025-03-25 00:57:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222674 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H8Cl2O7S |
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| Molecular Mass | 365.9368 |
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| SMILES | O=S(=O)(O)Oc1c(O)cc(O)cc1Oc1ccc(Cl)cc1Cl |
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| InChI Key | FQLMHHJBDHMZAL-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 | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl chloridesdiarylethersdichlorobenzeneshydrocarbon derivativesorganic oxidesorganochloridesphenol ethersphenoxy compoundsphenylsulfatesresorcinolssulfuric acid monoesters |
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| Substituents | diaryl etherphenol ethersulfuric acid monoesteretherorganochloride1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundresorcinol1,3-dichlorobenzenephenylsulfateorganic oxidearylsulfatearyl chloridechlorobenzeneorganic sulfuric acid or derivatives1-hydroxy-4-unsubstituted benzenoidaryl halidearomatic homomonocyclic compoundorganic oxygen compoundsulfate-esterphenolhydrocarbon derivativehalobenzenephenoxy compoundsulfuric acid esterdiphenyletherorganooxygen compound |
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