| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:39 UTC |
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| Update Date | 2025-03-21 18:32:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00089908 |
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| Frequency | 31.4 |
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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 | C=CC(=O)C1C(C)=CC(=O)CC1(C)C |
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| InChI Key | QJWUOUQDCZPUGF-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 | alpha,beta-unsaturated ketoneshydrocarbon derivativesorganic oxides |
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| Substituents | cyclohexenoneorganic oxidealiphatic homomonocyclic compoundhydrocarbon derivativealpha,beta-unsaturated ketone |
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