| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:27:28 UTC |
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| Update Date | 2025-03-24 14:19:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00836703 |
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| Frequency | 1.8 |
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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 | CCC(O)C(=O)Cl |
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| InChI Key | BPABAMAXBCSCQF-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organohalogen compounds |
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| Class | halohydrins |
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| Subclass | chlorohydrins |
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| Direct Parent | chlorohydrins |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyl chloridescarbonyl compoundshydrocarbon derivativesorganic oxidesorganochloridessecondary alcohols |
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| Substituents | alcoholaliphatic acyclic compoundcarbonyl groupchlorohydrinorganochlorideacyl halideorganic oxideorganic oxygen compoundacyl chloridesecondary alcoholhydrocarbon derivativeorganooxygen compound |
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