| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:57 UTC |
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| Update Date | 2025-03-25 00:54:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02203409 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H8F2O5 |
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| Molecular Mass | 198.034 |
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| SMILES | O=C(O)CC(F)(F)CC(O)C(=O)O |
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| InChI Key | FZXNYWQIUBTTLA-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 | hydroxy acids and derivatives |
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| Subclass | medium-chain hydroxy acids and derivatives |
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| Direct Parent | medium-chain hydroxy acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluoridesalpha hydroxy acids and derivativescarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativeshalogenated fatty acidshydrocarbon derivativeshydroxy fatty acidsmedium-chain fatty acidsorganic oxidesorganofluoridessecondary alcohols |
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| Substituents | halogenated fatty acidalcoholfatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalkyl fluorideorganofluoridealpha-hydroxy acidfatty acidcarboxylic acid derivativeorganohalogen compoundmedium-chain hydroxy acidorganic oxideorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativesalkyl halidehydrocarbon derivativemedium-chain fatty acidhydroxy fatty acidorganooxygen compound |
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