| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:52:52 UTC |
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| Update Date | 2025-03-21 18:03:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00045470 |
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| Frequency | 74.0 |
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| Structure | |
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| Chemical Formula | C4H3Cl3O3 |
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| Molecular Mass | 203.9148 |
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| SMILES | CC(=O)OC(=O)C(Cl)(Cl)Cl |
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| InChI Key | KEUSGCGDKJGEBB-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 | carboxylic acids and derivatives |
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| Subclass | dicarboxylic acids and derivatives |
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| Direct Parent | dicarboxylic acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chloridesalpha-halocarboxylic acid derivativescarbonyl compoundscarboxylic acid anhydrideshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | alpha-halocarboxylic acid or derivativesaliphatic acyclic compoundcarbonyl groupalkyl chlorideorganochlorideorganohalogen compoundalpha-halocarboxylic acid derivativeorganic oxideorganic oxygen compoundcarboxylic acid anhydridedicarboxylic acid or derivativesalkyl halidehydrocarbon derivativeorganooxygen compound |
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