| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:16 UTC |
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| Update Date | 2025-03-21 18:36:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00113420 |
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| Frequency | 23.3 |
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| Structure | |
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| Chemical Formula | C4H4Cl4O2 |
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| Molecular Mass | 223.8965 |
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| SMILES | CC(=O)OC(Cl)C(Cl)(Cl)Cl |
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| InChI Key | SQSVOFAGKLAMQX-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 | carboxylic acid derivatives |
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| Direct Parent | carboxylic acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chloridescarbonyl compoundshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl groupalkyl chlorideorganochlorideorganohalogen compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esteralkyl halidehydrocarbon derivativeorganooxygen compound |
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