| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:32 UTC |
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| Update Date | 2025-03-25 00:50:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182004 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H2F10O6S |
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| Molecular Mass | 403.9412 |
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| SMILES | O=C(O)C(F)(F)C(F)(F)C(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)O |
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| InChI Key | ARTJCWDPZCHGHX-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 | medium-chain keto acids and derivatives |
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| Direct Parent | medium-chain keto acids and derivatives |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluoridesalpha-halocarboxylic acidsalpha-haloketonescarboxylic acidsfatty acylsgamma-keto acids and derivativeshalogenated fatty acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganofluoridesorganosulfonic acidssulfonyls |
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| Substituents | alpha-halocarboxylic acid or derivativesfatty acylaliphatic acyclic compoundorganosulfonic acid or derivativescarbonyl groupcarboxylic acidorganosulfonic acidalpha-halocarboxylic acidorganosulfur compoundcarboxylic acid derivativeorganohalogen compoundketoneorganic oxidealpha-haloketonealkyl halidehalogenated fatty acidalkyl fluorideorganofluoridegamma-keto acidmonocarboxylic acid or derivativessulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeorganooxygen compoundmedium-chain keto acid |
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