| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:55:14 UTC |
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| Update Date | 2025-03-24 20:05:49 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01336028 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C6H5NOS |
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| Molecular Mass | 139.0092 |
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| SMILES | O=Cc1ccc[nH]c1=S |
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| InChI Key | VHHXNJFQRKYGKL-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 | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aryl-aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsorganosulfur compoundspyridine carboxaldehydesthiolactamsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesvinylogous amide3-pyridine carboxaldehydearomatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehydeorganosulfur compoundorganic oxidearyl-aldehydeorganic oxygen compoundthiolactamorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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