Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:47:50 UTC |
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Update Date | 2025-03-25 00:49:20 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02173510 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C13H24O4 |
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Molecular Mass | 244.1675 |
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SMILES | CCC(C)C(OC(=O)C(C)C)C(C)C(=O)OC |
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InChI Key | WNIYFYYCOFJOSU-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 acyclic compounds |
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Alternative Parents | carbonyl compoundsdicarboxylic acids and derivativeshydrocarbon derivativesmethyl estersorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativefatty acid esterorganic oxidemethyl esterorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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