| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:15:22 UTC |
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| Update Date | 2025-03-21 18:34:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00098955 |
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| Frequency | 27.8 |
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| Structure | |
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| Chemical Formula | C6H9F3O2 |
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| Molecular Mass | 170.0555 |
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| SMILES | CC(O)C(C)C(=O)C(F)(F)F |
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| InChI Key | DAGQADCUDUQGTN-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 fluoridesalpha-haloketoneshydrocarbon derivativesorganic oxidesorganofluoridessecondary alcohols |
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| Substituents | alcoholbeta-hydroxy ketonealiphatic acyclic compoundalkyl fluorideorganofluorideorganohalogen compoundorganic oxidesecondary alcoholalpha-haloketonealkyl halidehydrocarbon derivative |
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