| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:50:46 UTC |
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| Update Date | 2025-03-21 18:02:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00040336 |
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| Frequency | 85.7 |
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| Structure | |
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| Chemical Formula | C6H10O5 |
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| Molecular Mass | 162.0528 |
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| SMILES | CCC(=O)OC(CO)C(=O)O |
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| InChI Key | BVRULTOFGRKXSD-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 | carbohydrates and carbohydrate conjugates |
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| Direct Parent | sugar acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | beta hydroxy acids and derivativescarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic oxidesprimary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupcarboxylic acidhydroxy acidcarboxylic acid derivativebeta-hydroxy acidorganic oxideglyceric_acidcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeprimary alcohol |
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