| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:15 UTC |
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| Update Date | 2025-03-25 01:01:53 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02252254 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H13N3O3S |
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| Molecular Mass | 315.0678 |
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| SMILES | NS(=O)(=O)c1ccc(Nc2ccnc3cc(O)ccc23)cc1 |
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| InChI Key | MKLRKJSAQSMGTI-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | quinolines and derivatives |
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| Subclass | quinolines and derivatives |
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| Direct Parent | quinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesaminosulfonyl compoundsazacyclic compoundsbenzenesulfonamidesbenzenesulfonyl compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic oxidesorganooxygen compoundsorganopnictogen compoundsorganosulfonamidespolyhalopyridinessecondary amines |
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| Substituents | organosulfonic acid or derivativesmonocyclic benzene moietypolyhalopyridine1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganosulfonic acid amideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compound2-halopyridinebenzenesulfonyl groupbenzenesulfonamideazacycleaminosulfonyl compoundheteroaromatic compoundhydroxypyridinesecondary aminesulfonylpyridineorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
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