Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:28:49 UTC |
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Update Date | 2025-03-21 18:40:50 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00131410 |
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Frequency | 19.3 |
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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 | COC=C(C)C(=O)O |
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InChI Key | JQEBZBUGQPSANC-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 | vinylogous esters |
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Subclass | vinylogous esters |
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Direct Parent | vinylogous esters |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | carbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativescarboxylic acidorganic oxygen compoundvinylogous esterhydrocarbon derivativecarboxylic acid derivativeorganooxygen compound |
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