| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:13 UTC |
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| Update Date | 2025-03-25 00:52:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02194845 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H7ClO5 |
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| Molecular Mass | 181.9982 |
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| SMILES | CCOC(=O)C(O)(Cl)C(=O)O |
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| InChI Key | MIRZPIAZKRIVLL-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 | alcohols and polyolsalkyl chloridesalpha hydroxy acids and derivativesalpha-halocarboxylic acid derivativesalpha-halocarboxylic acidscarbonyl compoundscarboxylic acid esterscarboxylic acidshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | alcoholalpha-halocarboxylic acid or derivativesaliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl chlorideorganochloridealpha-hydroxy acidhydroxy acidalpha-halocarboxylic acidorganohalogen compoundalpha-halocarboxylic acid derivativeorganic oxideorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativesalkyl halidehydrocarbon derivativeorganooxygen compound |
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