| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:37:57 UTC |
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| Update Date | 2025-03-21 17:57:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00010715 |
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| Frequency | 437.6 |
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| Structure | |
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| Chemical Formula | C8H6O3 |
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| Molecular Mass | 150.0317 |
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| SMILES | O=CC(=O)c1ccc(O)cc1 |
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| InChI Key | MTMONFVFAYLRSG-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 | phenylacetaldehydes |
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| Direct Parent | phenylacetaldehydes |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalpha ketoaldehydesaryl ketonesbenzoyl derivativeshydrocarbon derivativesorganic oxides |
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| Substituents | carbonyl groupbenzoyl1-hydroxy-2-unsubstituted benzenoidaldehydeketonearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundphenolhydrocarbon derivativealpha-ketoaldehydeorganooxygen compoundaryl ketonephenylacetaldehyde |
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