Record Information |
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HMDB Status | detected |
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Creation Date | 2024-02-21 00:43:36 UTC |
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Update Date | 2025-03-21 18:49:21 UTC |
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HMDB ID | HMDB0245043 |
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Metabolite Identification |
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DeepMet ID | DMID00166001 |
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Name | 2-Butenoic acid, ethenyl ester |
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Frequency | 14.2 |
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Structure | |
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Chemical Formula | C6H8O2 |
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Molecular Mass | 112.0524 |
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SMILES | C=COC(=O)C=CC |
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InChI Key | IYNRVIKPUTZSOR-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 estersenol 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 derivativeenol esterorganooxygen compound |
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