| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:44:09 UTC |
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| Update Date | 2025-03-25 00:47:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02165072 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16O4 |
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| Molecular Mass | 212.1049 |
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| SMILES | CC=CC(=O)OC1(C(=O)O)CCCCC1 |
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| InChI Key | LNTUFXNTYGEMLN-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 acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aliphatic homomonocyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesenoate estershydrocarbon derivativesorganic oxides |
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| Substituents | enoate estercarbonyl groupcarboxylic acidcarboxylic acid derivativealpha,beta-unsaturated carboxylic esterfatty acid esterorganic oxideorganic oxygen compoundcarboxylic acid esteraliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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