| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:12:12 UTC |
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| Update Date | 2025-03-24 20:39:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01519378 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C7H11N2+ |
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| Molecular Mass | 123.0917 |
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| SMILES | Cc1ccc(N)[n+](C)c1 |
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| InChI Key | KCRGVZGZRAZYCZ-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 | 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 cationsorganopnictogen compoundsprimary aminespyridines and derivatives |
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| Substituents | n-methylpyridiniumaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary amine2-halopyridineorganic nitrogen compoundorganic cationamine |
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