| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:11 UTC |
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| Update Date | 2025-03-25 00:51:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190305 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H18O3 |
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| Molecular Mass | 234.1256 |
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| SMILES | CC(=O)C(=O)C=CC1C(C)=CC(=O)CC1(C)C |
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| InChI Key | XANQPGWNJADEHM-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | prenol lipids |
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| Subclass | sesquiterpenoids |
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| Direct Parent | sesquiterpenoids |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | acryloyl compoundsalpha-diketonescyclohexenonesenoneshydrocarbon derivativesorganic oxides |
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| Substituents | cyclohexenonecarbonyl groupmegastigmane sesquiterpenoidcyclic ketonealpha,beta-unsaturated ketonealpha-diketoneketoneorganic oxidesesquiterpenoidorganic oxygen compoundaliphatic homomonocyclic compoundhydrocarbon derivativeacryloyl-grouporganooxygen compoundenone |
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