| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:27:55 UTC |
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| Update Date | 2025-03-25 00:18:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01271395 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C4H3F3O2 |
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| Molecular Mass | 140.0085 |
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| SMILES | C=C(O)C(=O)C(F)(F)F |
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| InChI Key | IHPOJXCEPUOEFI-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 | alpha-branched alpha,beta-unsaturated ketones |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | acryloyl compoundsalkyl fluoridesalpha-haloketonesalpha-hydroxy ketonesenoneshydrocarbon derivativesorganic oxidesorganofluorides |
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| Substituents | alpha-branched alpha,beta-unsaturated-ketonealiphatic acyclic compoundalkyl fluorideorganofluoridealpha-hydroxy ketoneorganohalogen compoundketoneorganic oxidealpha-haloketonealkyl halidehydrocarbon derivativeacryloyl-groupenone |
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