| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:42:26 UTC |
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| Update Date | 2025-03-21 17:59:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00020738 |
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| Frequency | 194.7 |
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| Structure | |
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| Chemical Formula | C8H11N2O+ |
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| Molecular Mass | 151.0866 |
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| SMILES | CNC(=O)c1ccc[n+](C)c1 |
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| InChI Key | ZSNWTWMEBZBBSV-UHFFFAOYSA-O |
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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 | azacyclic compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesn-methylpyridinium compoundsnicotinamidesorganic cationsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssecondary carboxylic acid amidesvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesvinylogous amiden-methylpyridiniumaromatic heteromonocyclic compoundazacyclenicotinamideheteroaromatic compoundmethylpyridinecarboxamide groupcarboxylic acid derivativesecondary carboxylic acid amideorganic oxideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compound |
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