| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:52 UTC |
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| Update Date | 2025-03-25 00:56:58 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02221869 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C8H5NO7S |
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| Molecular Mass | 258.9787 |
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| SMILES | O=c1cc(O)c2nc(OS(=O)(=O)O)ccc2o1 |
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| InChI Key | BSKUZLVMIABQAN-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 | pyranopyridines |
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| Subclass | pyranopyridines |
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| Direct Parent | pyranopyridines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesarylsulfatesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridineslactonesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinespyranones and derivativessulfuric acid monoestersvinylogous acids |
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| Substituents | sulfuric acid monoesterpolyhalopyridinelactoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundpyranoneorganopnictogen compoundarylsulfate2-halopyridineorganic sulfuric acid or derivativesazacycleheteroaromatic compoundhydroxypyridineoxacyclevinylogous acidpyridineorganic oxygen compoundpyransulfate-esterhydrocarbon derivativeorganic nitrogen compoundsulfuric acid esterpyranopyridineorganooxygen compound |
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