Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:40:14 UTC |
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Update Date | 2025-03-21 17:58:40 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00015928 |
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Frequency | 270.5 |
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Structure | |
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Chemical Formula | C8H6F13NO2S |
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Molecular Mass | 426.9912 |
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SMILES | CN(C)S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F |
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InChI Key | XXWVQQPYWSIJGT-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 | organic sulfonamides |
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Direct Parent | organic sulfonamides |
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Geometric Descriptor | aliphatic acyclic compounds |
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Alternative Parents | alkyl fluoridesaminosulfonyl compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamides |
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Substituents | aliphatic acyclic compoundorganosulfonic acid or derivativesaminosulfonyl compoundalkyl fluorideorganofluorideorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxidesulfonylorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundalkyl halidehydrocarbon derivativeorganic nitrogen compoundorganic sulfonic acid amide |
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