| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:36 UTC |
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| Update Date | 2025-03-21 18:05:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058847 |
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| Frequency | 53.6 |
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| Structure | |
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| Chemical Formula | C13H13ClN2O3S |
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| Molecular Mass | 312.0335 |
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| SMILES | NS(=O)(=O)c1ccc(NCc2ccccc2O)cc1Cl |
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| InChI Key | QSWVGBZEKSUPNY-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 | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsaminosulfonyl compoundsaryl chloridesbenzenesulfonyl compoundschlorobenzeneshydrocarbon derivativesorganic oxidesorganochloridesorganooxygen compoundsorganopnictogen compoundsorganosulfonamidesphenylalkylaminessecondary alkylarylamines |
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| Substituents | organosulfonic acid or derivativesorganochloride1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganohalogen compoundorganosulfonic acid amideorganic oxideorganonitrogen compoundorganopnictogen compoundbenzenesulfonyl grouparyl chloridechlorobenzenebenzenesulfonamideaminosulfonyl compound1-hydroxy-4-unsubstituted benzenoidsecondary aminesecondary aliphatic/aromatic aminearyl halidearomatic homomonocyclic compoundsulfonylorganic oxygen compoundorganic sulfonic acid or derivativesphenylalkylaminephenolhydrocarbon derivativeorganic nitrogen compoundhalobenzeneamineorganooxygen compound |
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