| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:27:38 UTC |
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| Update Date | 2025-03-21 18:40:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00128583 |
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| Frequency | 19.8 |
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| Structure | |
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| Chemical Formula | C5H5NO4S |
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| Molecular Mass | 174.9939 |
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| SMILES | O=S(=O)(O)c1ccc(O)nc1 |
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| InChI Key | OCENUUORNQBOIA-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | organic sulfonic acids and derivatives |
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| Subclass | organosulfonic acids and derivatives |
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| Direct Parent | arylsulfonic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1-sulfo,2-unsubstituted aromatic compounds2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonic acidspolyhalopyridinessulfonyls |
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| Substituents | aromatic heteromonocyclic compound1-sulfo,2-unsubstituted aromatic compoundazacyclepolyhalopyridineheteroaromatic compoundorganosulfonic acidhydroxypyridineorganosulfur compoundorganic oxidesulfonylpyridinearylsulfonic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganoheterocyclic compoundorganooxygen compound |
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