| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:43:42 UTC |
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| Update Date | 2025-03-25 00:47:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02164041 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H18O3 |
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| Molecular Mass | 246.1256 |
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| SMILES | CC1=C(C(=O)C=CC=CC(=O)O)C(C)(C)CC=C1 |
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| InChI Key | QSZIRQJTOLJWQL-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 | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | carbocyclic fatty acids |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | alpha,beta-unsaturated ketonescarboxylic acidshydrocarbon derivativesketonesmedium-chain fatty acidsmonocarboxylic acids and derivativesorganic oxidesunsaturated fatty acids |
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| Substituents | carbocyclic fatty acidcarbonyl groupcarboxylic acidalpha,beta-unsaturated ketonecarboxylic acid derivativeketoneunsaturated fatty acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic homomonocyclic compoundhydrocarbon derivativemedium-chain fatty acidorganooxygen compound |
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