| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:49:53 UTC |
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| Update Date | 2025-03-25 00:50:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02178287 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H14O3 |
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| Molecular Mass | 182.0943 |
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| SMILES | COC(=O)C1=CCC(C)(C)CC1=O |
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| InChI Key | DRVJROGQZRPKMM-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 | enoate estershydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | enoate estercyclohexenonecarboxylic acid derivativealpha,beta-unsaturated carboxylic esterorganic oxidemonocarboxylic acid or derivativesmethyl estercarboxylic acid esteraliphatic homomonocyclic compoundhydrocarbon derivative |
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