| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:32:26 UTC |
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| Update Date | 2025-03-25 00:19:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01281838 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C4H5FO3 |
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| Molecular Mass | 120.0223 |
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| SMILES | O=C(O)C(F)=CCO |
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| InChI Key | CAYNHVKVMRLXEZ-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 | alpha-halocarboxylic acidscarbonyl compoundscarboxylic acidsfluoroalkeneshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganofluoridesprimary alcoholsshort-chain hydroxy acids and derivativesunsaturated fatty acidsvinyl fluorides |
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| Substituents | alpha-halocarboxylic acid or derivativesaliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-halocarboxylic acidvinyl fluoridecarboxylic acid derivativeorganohalogen compoundunsaturated fatty acidorganic oxidehydroxy fatty acidfluoroalkeneprimary alcoholalcoholhalogenated fatty acidorganofluoridemonocarboxylic acid or derivativesorganic oxygen compoundvinyl halidehaloalkenehydrocarbon derivativeorganooxygen compound |
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