Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:16:44 UTC |
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Update Date | 2025-03-21 18:34:45 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00102330 |
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Frequency | 26.6 |
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Structure | |
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Chemical Formula | C9H16O2 |
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Molecular Mass | 156.115 |
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SMILES | CCCC=CC(=O)OCCC |
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InChI Key | YYHOZECIUCTJDJ-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 compoundsenoate estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | enoate esteraliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativealpha,beta-unsaturated carboxylic esterfatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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