| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:18:12 UTC |
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| Update Date | 2025-03-25 01:00:29 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02242869 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H20O2 |
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| Molecular Mass | 244.1463 |
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| SMILES | C=CC(=O)Cc1c(C)c(C)c(C)c(C(C)=O)c1C |
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| InChI Key | PCIKVTBETFMXFL-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 | acetophenonesacryloyl compoundsaryl alkyl ketonesbenzoyl derivativesenoneshydrocarbon derivativesorganic oxides |
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| Substituents | monocyclic benzene moietyaryl alkyl ketonebenzoylalpha,beta-unsaturated ketonearomatic homomonocyclic compoundorganic oxideacetophenonehydrocarbon derivativebenzenoidacryloyl-groupalkyl-phenylketoneenone |
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