Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:18:05 UTC |
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Update Date | 2025-03-21 18:35:26 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00105628 |
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Frequency | 25.6 |
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Structure | |
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Chemical Formula | C8H7ClO3 |
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Molecular Mass | 186.0084 |
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SMILES | CC(=O)Oc1ccc(Cl)cc1O |
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InChI Key | LKUVZFUBWSCGEV-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 | phenol esters |
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Subclass | phenol esters |
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Direct Parent | phenol esters |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaryl chloridescarbonyl compoundscarboxylic acid esterschlorobenzeneshalophenolshydrocarbon derivativesm-chlorophenolsmonocarboxylic acids and derivativesorganic oxidesorganochloridesphenoxy compounds |
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Substituents | monocyclic benzene moietycarbonyl grouporganochloride1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativeorganohalogen compoundorganic oxidearyl chloridechlorobenzene3-halophenol3-chlorophenol1-hydroxy-4-unsubstituted benzenoidaryl halidearomatic homomonocyclic compoundmonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterphenol esterphenolhydrocarbon derivativehalobenzenephenoxy compoundorganooxygen compound |
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