Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 01:09:25 UTC |
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Update Date | 2025-03-21 19:05:19 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00226070 |
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Frequency | 9.5 |
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Structure | |
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Chemical Formula | C5H8O3 |
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Molecular Mass | 116.0473 |
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SMILES | C=COC(=O)C(C)O |
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InChI Key | MPOGZNTVZCEKSW-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 | carboxylic acids and derivatives |
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Subclass | carboxylic acid derivatives |
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Direct Parent | enol esters |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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Substituents | alcoholaliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeenol esterorganooxygen compound |
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