| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:47:00 UTC |
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| Update Date | 2025-03-21 18:01:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00031330 |
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| Frequency | 117.7 |
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| Structure | |
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| Chemical Formula | C3H3ClO3 |
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| Molecular Mass | 121.9771 |
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| SMILES | O=C(O)C(=O)CCl |
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| InChI Key | RCWFNCXDFSOVLG-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 | keto acids and derivatives |
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| Subclass | alpha-keto acids and derivatives |
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| Direct Parent | alpha-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chloridesalpha-chloroketonesalpha-hydroxy ketonescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl chlorideorganochloridealpha-hydroxy ketonecarboxylic acid derivativeorganohalogen compoundalpha-chloroketoneketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalpha-keto acidalpha-haloketonealkyl halidehydrocarbon derivativeorganooxygen compound |
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