| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:57:59 UTC |
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| Update Date | 2025-03-25 00:52:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196588 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H6F12O3S |
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| Molecular Mass | 409.9846 |
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| SMILES | CCC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)O |
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| InChI Key | CRTXWEGRSTWVGC-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 | organic sulfonic acids and derivatives |
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| Subclass | organosulfonic acids and derivatives |
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| Direct Parent | organosulfonic acids |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | alkyl fluorideshydrocarbon derivativesorganic oxidesorganofluoridessulfonyls |
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| Substituents | aliphatic acyclic compoundalkyl fluorideorganofluorideorganosulfonic acidorganosulfur compoundorganohalogen compoundorganic oxidesulfonylorganic oxygen compoundalkyl halidehydrocarbon derivative |
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