| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 07:11:53 UTC |
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| Update Date | 2025-03-24 19:56:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01085901 |
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| Frequency | 1.3 |
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| Structure | |
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| Chemical Formula | C4H6FNO3 |
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| Molecular Mass | 135.0332 |
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| SMILES | NCC(=O)C(F)C(=O)O |
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| InChI Key | XTAWQBMNEDJNLR-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-halocarboxylic acidsalpha-haloketonesbeta-hydroxy ketonesbeta-keto acids and derivativescarboxylic acidsfatty acylshydrocarbon derivativesmonoalkylaminesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundsshort-chain keto acids and derivatives |
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| Substituents | alpha-halocarboxylic acid or derivativesbeta-hydroxy ketonealiphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidalpha-halocarboxylic acidcarboxylic acid derivativeorganohalogen compoundbeta-keto acidketoneorganic oxideorganonitrogen compoundorganopnictogen compoundalpha-haloketonealkyl halidehalogenated fatty acidalkyl fluorideorganofluoridemonocarboxylic acid or derivativesorganic oxygen compoundketo acidhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound1,3-dicarbonyl compoundorganooxygen compound |
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