Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:33 UTC |
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Update Date | 2025-03-21 18:35:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00104358 |
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Frequency | 26.0 |
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Structure | |
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Chemical Formula | C9H7NO5S |
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Molecular Mass | 241.0045 |
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SMILES | O=S(=O)(O)c1cc(O)c2cccc(O)c2n1 |
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InChI Key | IBDPXPQVWBGEAH-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 | 8-hydroxyquinolines |
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Direct Parent | 8-hydroxyquinolines |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoids2-halopyridinesarylsulfonic acids and derivativesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonic acidspolyhalopyridinessulfonyls |
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Substituents | organosulfonic acid or derivativespolyhalopyridineorganosulfonic acid1-hydroxy-2-unsubstituted benzenoidorganosulfur compoundorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridine8-hydroxyquinolineazacycleheteroaromatic compoundhydroxypyridine1-hydroxy-4-unsubstituted benzenoidsulfonylpyridinearylsulfonic acid or derivativesorganic oxygen compoundorganic sulfonic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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