| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:40 UTC |
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| Update Date | 2025-03-25 00:52:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02195886 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H16O3 |
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| Molecular Mass | 256.1099 |
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| SMILES | CC1=C(C(C)C)C(O)=C(C(=O)c2ccccc2)C1=O |
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| InChI Key | WQIXWYQAQOGCNU-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 | benzoyl derivatives |
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| Direct Parent | benzoyl derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | aryl ketonescyclic ketoneshydrocarbon derivativesorganic oxidesvinylogous acids |
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| Substituents | carbonyl groupbenzoylcyclic ketoneketonearomatic homomonocyclic compoundvinylogous acidorganic oxideorganic oxygen compoundhydrocarbon derivativeorganooxygen compoundaryl ketone |
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