| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:31:37 UTC |
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| Update Date | 2025-03-25 00:19:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01279865 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C9H12N+ |
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| Molecular Mass | 134.0964 |
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| SMILES | C=Cc1ccc[n+](C)c1C |
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| InChI Key | QETUPLLUEIITPI-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 | polyhalopyridines |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesn-methylpyridinium compoundsorganic cationsorganonitrogen compoundsorganopnictogen compoundspyridines and derivatives |
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| Substituents | n-methylpyridiniumaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cation |
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