| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:02 UTC |
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| Update Date | 2025-03-25 00:52:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196691 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H14O4 |
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| Molecular Mass | 174.0892 |
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| SMILES | CCC(O)C(OC(C)=O)C(C)=O |
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| InChI Key | SNJBHTQXQIAIEG-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 | carbonyl compounds |
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| Direct Parent | alpha-acyloxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | beta-hydroxy ketonescarboxylic acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidessecondary alcohols |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundalpha-acyloxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativescarboxylic acid estersecondary alcoholhydrocarbon derivative |
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