| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:29 UTC |
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| Update Date | 2025-03-21 18:40:02 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00128218 |
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| Frequency | 19.9 |
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| Structure | |
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| Chemical Formula | C5H5F5O3 |
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| Molecular Mass | 208.0159 |
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| SMILES | CC(O)(C(=O)O)C(F)(F)C(F)(F)F |
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| InChI Key | CUAMIJMGTAEUHX-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 acids and derivativescarbonyl compoundscarboxylic acidsfluorohydrinshydrocarbon derivativeshydroxy fatty acidsmethyl-branched fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganofluoridesshort-chain hydroxy acids and derivativestertiary alcohols |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidalpha-hydroxy acidfluorohydrincarboxylic acid derivativeorganohalogen compoundorganic oxidealkyl halidehydroxy fatty acidhalogenated fatty acidalcoholmethyl-branched fatty acidhalohydrinalkyl fluorideorganofluoridehydroxy acidbranched fatty acidtertiary alcoholmonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
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