| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:46:20 UTC |
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| Update Date | 2025-03-25 00:48:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02170050 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C23H40O6 |
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| Molecular Mass | 412.2825 |
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| SMILES | CCCCCCCCCCCCCCCC(=O)OC1CC(C(=O)O)=CC(O)C1O |
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| InChI Key | BVDVEJXERFGDLQ-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 | 1,2-diolscarbonyl compoundscarboxylic acid esterscarboxylic acidscyclitols and derivativesdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholcarbonyl groupcarboxylic acidcyclitol or derivativescarboxylic acid derivativefatty acid esterorganic oxideorganic oxygen compoundcarboxylic acid estersecondary alcoholaliphatic homomonocyclic compounddicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound1,2-diol |
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