| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:40:15 UTC |
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| Update Date | 2025-03-25 00:46:38 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02156376 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C7H7N2+ |
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| Molecular Mass | 119.0604 |
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| SMILES | C[n+]1ccccc1C#N |
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| InChI Key | QCKQICVQNDDMCF-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 | methylpyridines |
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| Direct Parent | n-methylpyridinium compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesnitrilesorganic cationsorganonitrogen compoundsorganopnictogen compoundspyridines and derivatives |
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| Substituents | nitrilen-methylpyridiniumaromatic heteromonocyclic compoundazacycleheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cationcarbonitrile |
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