| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:02:42 UTC |
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| Update Date | 2025-03-25 00:54:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02207406 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H6ClF3N2O2S |
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| Molecular Mass | 273.9791 |
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| SMILES | Nc1cc(Cl)c(S(N)(=O)=O)cc1C(F)(F)F |
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| InChI Key | JNULECUDBAOOQP-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | benzenesulfonamides |
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| Direct Parent | benzenesulfonamides |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alkyl fluoridesaminosulfonyl compoundsaryl chloridesbenzenesulfonyl compoundschlorobenzeneshydrocarbon derivativesorganic oxidesorganochloridesorganofluoridesorganopnictogen compoundsorganosulfonamidesprimary aminestrifluoromethylbenzenes |
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| Substituents | organosulfonic acid or derivativesorganochlorideorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundalkyl halidetrifluoromethylbenzenebenzenesulfonyl grouparyl chloridechlorobenzenebenzenesulfonamideaminosulfonyl compoundalkyl fluorideorganofluoridearyl halidearomatic homomonocyclic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativeprimary amineorganic nitrogen compoundhalobenzeneamine |
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