| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:55:36 UTC |
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| Update Date | 2025-03-24 18:01:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01047658 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C3H3ClO4 |
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| Molecular Mass | 137.972 |
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| SMILES | O=C(O)C(=O)C(O)Cl |
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| InChI Key | QYVBMUHUAIWPIU-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 | alcohols and polyolsalkyl chloridesalpha-chloroketonesalpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl chlorideorganochloridemonosaccharidealpha-hydroxy ketonecarboxylic acid derivativeorganohalogen compoundketonebeta-hydroxy acidsaccharideorganic oxidealpha-keto acidalpha-haloketonealkyl halidealcoholalpha-chloroketonemonocarboxylic acid or derivativesorganic oxygen compoundketo acidhydrocarbon derivativeorganooxygen compound |
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