| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:45:44 UTC |
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| Update Date | 2025-03-25 00:48:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02168680 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10F2O4 |
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| Molecular Mass | 196.0547 |
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| SMILES | CC(C)C(=O)C(F)(F)C(O)C(=O)O |
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| InChI Key | NFHZDJQIEPCLKZ-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | keto acids and derivatives |
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| Subclass | medium-chain keto acids and derivatives |
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| Direct Parent | medium-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluoridesalpha hydroxy acids and derivativesalpha-haloketonesbeta-hydroxy ketonesbranched fatty acidscarboxylic acidsfatty acylsfluorohydrinsgamma-keto acids and derivativeshalogenated fatty acidshydrocarbon derivativeshydroxy fatty acidsmonocarboxylic acids and derivativesorganic oxidesorganofluoridessecondary alcohols |
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| Substituents | fatty acylbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy acidfluorohydrincarboxylic acid derivativeorganohalogen compoundketoneorganic oxidealpha-haloketonealkyl halidehydroxy fatty acidhalogenated fatty acidalcoholhalohydrinalkyl fluorideorganofluoridehydroxy acidbranched fatty acidgamma-keto acidmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compoundmedium-chain keto acid |
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