| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:45 UTC |
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| Update Date | 2025-03-25 00:51:27 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02187095 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H10F2O5 |
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| Molecular Mass | 212.0496 |
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| SMILES | CC(C(=O)O)C(F)(F)CC(O)C(=O)O |
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| InChI Key | JSGCENKVDYGQJG-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 acidsmethyl-branched fatty acidsorganic oxidesorganofluoridessecondary alcohols |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy acidfatty acidcarboxylic acid derivativeorganohalogen compoundmedium-chain hydroxy acidorganic oxidealkyl halidemedium-chain fatty acidhydroxy fatty acidhalogenated fatty acidalcoholmethyl-branched fatty acidalkyl fluorideorganofluoridebranched fatty acidorganic oxygen compoundsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativeorganooxygen compound |
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