| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:41:52 UTC |
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| Update Date | 2025-03-21 21:55:39 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00442514 |
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| Frequency | 4.0 |
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| Structure | |
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| Chemical Formula | C6H10O3 |
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| Molecular Mass | 130.063 |
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| SMILES | C=C(C(=O)OC)C(C)O |
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| InChI Key | VLCAYQIMSMPEBW-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | hydroxy acids and derivatives |
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| Subclass | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundsenoate estersfatty acid estershydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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| Substituents | enoate esteralcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativealpha,beta-unsaturated carboxylic esterfatty acid esterbeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundcarboxylic acid estersecondary alcoholhydrocarbon derivativeorganooxygen compound |
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