| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:55:11 UTC |
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| Update Date | 2025-03-25 00:51:56 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02190331 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C4H7ClO2 |
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| Molecular Mass | 122.0135 |
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| SMILES | CC(=O)C(Cl)CO |
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| InChI Key | CLMNQCJJVRIRTE-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | beta-hydroxy ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl chloridesalpha-chloroketoneschlorohydrinshydrocarbon derivativesorganic oxidesorganochloridesprimary alcohols |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundchlorohydrinhalohydrinalkyl chlorideorganochlorideorganohalogen compoundalpha-chloroketoneorganic oxidealpha-haloketonealkyl halidehydrocarbon derivativeprimary alcohol |
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