| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:21 UTC |
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| Update Date | 2025-03-21 18:32:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091624 |
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| Frequency | 30.6 |
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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 | CCC(C(=O)O)C(=O)C(F)(F)F |
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| InChI Key | VZOGIRGGDUOBBK-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 | 1,3-dicarbonyl compoundsalkyl fluoridesalpha-haloketonesbeta-hydroxy ketonesbeta-keto acids and derivativesbranched fatty acidscarboxylic acidsfatty acylshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesshort-chain keto acids and derivatives |
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| Substituents | halogenated fatty acidbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl fluorideorganofluorideshort-chain keto acidcarboxylic acid derivativeorganohalogen compoundbranched fatty acidbeta-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundketo acidalpha-haloketonealkyl halidehydrocarbon derivative1,3-dicarbonyl compoundorganooxygen compound |
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