Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:18:04 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 | DMID00105603 |
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Frequency | 25.6 |
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Structure | |
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Chemical Formula | C8H8O4 |
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Molecular Mass | 168.0423 |
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SMILES | CC(=O)c1cc(O)c(O)cc1O |
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InChI Key | WCJLAYDOJJYRHF-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organooxygen compounds |
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Subclass | carbonyl compounds |
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Direct Parent | alkyl-phenylketones |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsacetophenonesaryl alkyl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxidesorganooxygen compoundsvinylogous acids |
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Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoyl1-hydroxy-2-unsubstituted benzenoidaromatic homomonocyclic compoundvinylogous acidorganic oxideacetophenonephenolhydrocarbon derivativebenzenoidalkyl-phenylketone |
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