| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:21 UTC |
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| Update Date | 2025-03-21 18:03:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00041725 |
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| Frequency | 82.2 |
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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(Cl)C(=O)O |
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| InChI Key | AFXWHCJMTLWFKF-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 | 1,3-dicarbonyl compoundsalkyl chloridesalpha-halocarboxylic acidscarboxylic acidshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | alpha-halocarboxylic acid or derivativesaliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl chlorideorganochloridealpha-halocarboxylic acidorganohalogen compoundorganic oxideorganic oxygen compounddicarboxylic acid or derivativesalkyl halidehydrocarbon derivative1,3-dicarbonyl compoundorganooxygen compound |
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