| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:20:18 UTC |
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| Update Date | 2025-03-21 18:36:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00111062 |
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| Frequency | 24.0 |
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| Structure | |
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| Chemical Formula | C18H15F3N2O2S |
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| Molecular Mass | 380.0806 |
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| SMILES | Cc1ccc(-c2cc(C(F)(F)F)cn2-c2ccc(S(N)(=O)=O)cc2)cc1 |
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| InChI Key | UNSZVOILXXGQSN-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 heteromonocyclic compounds |
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| Alternative Parents | alkyl fluoridesaminosulfonyl compoundsazacyclic compoundsbenzenesulfonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundsorganosulfonamidessubstituted pyrrolestoluenes |
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| Substituents | organosulfonic acid or derivativesaromatic heteromonocyclic compoundsubstituted pyrroleorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundalkyl halideorganoheterocyclic compoundbenzenesulfonyl groupbenzenesulfonamideazacycleaminosulfonyl compoundalkyl fluorideorganofluorideheteroaromatic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativespyrrolehydrocarbon derivativeorganic nitrogen compoundtoluene |
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