| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:25:00 UTC |
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| Update Date | 2025-03-21 18:38:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00122384 |
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| Frequency | 21.1 |
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| Structure | |
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| Chemical Formula | C5H5F3O3 |
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| Molecular Mass | 170.0191 |
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| SMILES | O=C(O)C(=O)CCC(F)(F)F |
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| InChI Key | QEYYZUYXOGLKSR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acids and conjugates |
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| Direct Parent | halogenated fatty acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluoridesalpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidsfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesshort-chain keto acids and derivatives |
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| Substituents | halogenated fatty acidaliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl fluorideorganofluorideshort-chain keto acidalpha-hydroxy ketonecarboxylic acid derivativeorganohalogen compoundketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidalpha-keto acidalkyl halidehydrocarbon derivativeorganooxygen compound |
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