| Record Information |
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| HMDB Status | detected |
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| Creation Date | 2024-02-21 00:02:46 UTC |
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| Update Date | 2025-03-21 18:07:21 UTC |
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| HMDB ID | HMDB0245193 |
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| Metabolite Identification |
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| DeepMet ID | DMID00068801 |
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| Name | 2-Mercaptonicotinic acid |
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| Frequency | 64.2 |
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| Structure | |
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| Chemical Formula | C6H5NO2S |
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| Molecular Mass | 155.0041 |
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| SMILES | O=C(O)c1ccc[nH]c1=S |
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| InChI Key | WYKHFQKONWMWQM-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 | pyridines and derivatives |
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| Subclass | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridine-3-carboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfur compoundsthiolactamsvinylogous amides |
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| Substituents | vinylogous amidecarboxylic acidaromatic heteromonocyclic compoundazacyclepyridine-3-carboxylic acidheteroaromatic compoundhydroxypyridineorganosulfur compoundcarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundthiolactamorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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