| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:40:43 UTC |
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| Update Date | 2025-03-21 17:58:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00016932 |
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| Frequency | 250.7 |
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| Structure | |
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| Chemical Formula | C12H16O2 |
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| Molecular Mass | 192.115 |
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| SMILES | CC1=CC(=O)CC(C)(C)C1C=CC=O |
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| InChI Key | ZHPBGSDELGQQKO-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 | cyclohexenones |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | aldehydeshydrocarbon derivativesorganic oxides |
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| Substituents | cyclohexenoneorganic oxidealiphatic homomonocyclic compoundaldehydehydrocarbon derivative |
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