Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:44:58 UTC |
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Update Date | 2025-03-25 00:48:15 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02167016 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C14H9Cl3O3 |
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Molecular Mass | 329.9617 |
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SMILES | CC(=O)Oc1cc(Cl)ccc1Oc1ccc(Cl)c(Cl)c1 |
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InChI Key | FRZMVMMHVDOMEY-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 chloridescarbonyl compoundscarboxylic acid estersdiarylethersdichlorobenzeneshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesphenol estersphenol ethersphenoxy compounds |
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Substituents | diaryl etherphenol ethercarbonyl groupetherorganochloridecarboxylic acid derivativeorganohalogen compoundorganic oxide1,2-dichlorobenzenearyl chloridechlorobenzenearyl halidearomatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterphenol esterhydrocarbon derivativehalobenzenephenoxy compounddiphenyletherorganooxygen compound |
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