| Record Information |
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| HMDB Status | expected |
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| Creation Date | 2024-02-21 01:20:01 UTC |
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| Update Date | 2025-03-21 19:11:36 UTC |
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| HMDB ID | HMDB0029582 |
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| Metabolite Identification |
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| DeepMet ID | DMID00250923 |
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| Name | Methyl sorbate |
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| Frequency | 8.3 |
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| Structure | |
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| Chemical Formula | C7H10O2 |
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| Molecular Mass | 126.0681 |
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| SMILES | CC=CC=CC(=O)OC |
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| InChI Key | KWKVAGQCDSHWFK-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 derivativesmethyl estersmonocarboxylic 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 derivativesmethyl esterorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganooxygen compound |
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