| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:33:38 UTC |
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| Update Date | 2025-03-21 21:51:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00422975 |
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| Frequency | 4.2 |
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| Structure | |
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| Chemical Formula | C5H10O3 |
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| Molecular Mass | 118.063 |
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| SMILES | CC(C)(O)COC=O |
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| InChI Key | YTAIUAKINZCBMX-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | alcohols and polyols |
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| Direct Parent | tertiary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouptertiary alcoholorganic oxidemonocarboxylic acid or derivativescarboxylic acid esterhydrocarbon derivativecarboxylic acid derivative |
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