| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:04:03 UTC |
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| Update Date | 2025-03-25 00:55:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02210664 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H7F3O3 |
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| Molecular Mass | 184.0347 |
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| SMILES | CC(=O)CC(C(=O)O)C(F)(F)F |
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| InChI Key | KCPIBLAWMWWJAZ-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 | gamma-keto acids and derivatives |
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| Direct Parent | gamma-keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluoridesbranched fatty acidscarboxylic acidsfatty acylshalogenated fatty acidshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesshort-chain keto acids and derivatives |
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| Substituents | halogenated fatty acidfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl fluorideorganofluorideshort-chain keto acidcarboxylic acid derivativeorganohalogen compoundbranched fatty acidgamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalkyl halidehydrocarbon derivativeorganooxygen compound |
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