| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 06:00:11 UTC |
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| Update Date | 2025-03-24 16:36:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00914804 |
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| Frequency | 1.6 |
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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)CC(=O)Cl |
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| InChI Key | SIBIGACKSFGLHF-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 | alcohols and polyols |
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| Direct Parent | secondary alcohols |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acyl chloridescarbonyl compoundshydrocarbon derivativesorganic oxidesorganochlorides |
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| Substituents | aliphatic acyclic compoundcarbonyl grouporganochlorideorganohalogen compoundacyl halideorganic oxideacyl chloridesecondary alcoholhydrocarbon derivative |
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