| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:15:19 UTC |
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| Update Date | 2025-03-25 00:59:17 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02236295 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H9NO6S |
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| Molecular Mass | 283.0151 |
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| SMILES | COS(=O)(=O)c1ccc2[nH]c(C(=O)O)cc(=O)c2c1 |
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| InChI Key | YNQDEOSQKXVQJK-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 | quinoline carboxylic acids |
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| Direct Parent | quinoline carboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesarylsulfonic acids and derivativesazacyclic compoundsbenzenoidscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneshydroxypyridinesmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfonic acid esterspolyhalopyridinespyridine-2-carboxylic acidssulfonylsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesorganosulfonic acid or derivativescarboxylic acidpolyhalopyridineorganosulfur compoundcarboxylic acid derivativeorganic oxidepyridine-2-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amideazacycleheteroaromatic compoundhydroxypyridinedihydroquinolinemethylpyridineorganosulfonic acid estermonocarboxylic acid or derivativesdihydroquinolonesulfonylpyridineorganic oxygen compoundarylsulfonic acid or derivativesorganic sulfonic acid or derivativespyridine carboxylic acidquinoline-2-carboxylic acidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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