| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 02:59:25 UTC |
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| Update Date | 2025-03-21 22:03:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00483731 |
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| Frequency | 3.6 |
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| Structure | |
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| Chemical Formula | C4H8O5 |
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| Molecular Mass | 136.0372 |
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| SMILES | O=C(CC(O)CO)OO |
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| InChI Key | OZQLJIMVCBCLKN-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 | hydroxy acids and derivatives |
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| Subclass | beta hydroxy acids and derivatives |
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| Direct Parent | beta hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | 1,2-diolscarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic hydroperoxidesorganic oxidesperoxolsperoxycarboxylic acids and derivativesprimary alcoholssecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl grouphydroperoxidecarboxylic acid derivativeperoxolbeta-hydroxy acidorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundperoxycarboxylic acid or derivativessecondary alcoholhydrocarbon derivativeprimary alcoholorganooxygen compound1,2-diol |
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