| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:19:16 UTC |
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| Update Date | 2025-03-24 20:42:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01536523 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H8O3 |
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| Molecular Mass | 128.0473 |
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| SMILES | CC(=O)OC=C(C)C=O |
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| InChI Key | MAAFWJSXICAAQW-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 | aldehydeshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaldehydehydrocarbon derivativeenol esterorganooxygen compound |
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