| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:22:24 UTC |
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| Update Date | 2025-03-24 20:43:41 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01544118 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H6N2S |
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| Molecular Mass | 138.0252 |
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| SMILES | NC(=S)c1ccccn1 |
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| InChI Key | HYKQYVSNFPWGKQ-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 | halopyridines |
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| Direct Parent | 2-halopyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundsheteroaromatic compoundshydrocarbon derivativesorganonitrogen compoundsorganopnictogen compoundspyridines and derivativesthioamidesthiocarbonyl compoundsthiocarboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacyclethiocarboxylic acid amideheteroaromatic compoundthiocarbonyl grouporganosulfur compoundthioamideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compound |
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