| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:50:47 UTC |
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| Update Date | 2025-03-24 21:48:26 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01897521 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C2H3ClO2S |
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| Molecular Mass | 125.9542 |
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| SMILES | O=C(O)C(S)Cl |
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| InChI Key | JWIBMNLIDDOKRJ-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 | alpha-halocarboxylic acids and derivatives |
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| Direct Parent | alpha-halocarboxylic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chloridesalkylthiolscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganochloridesorganosulfur compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl chlorideorganochloridealpha-halocarboxylic acidorganosulfur compoundorganohalogen compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalkyl halidehydrocarbon derivativealkylthiolorganooxygen compound |
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