| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 08:27:04 UTC |
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| Update Date | 2025-03-25 00:17:52 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01269424 |
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| Frequency | 1.0 |
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| Structure | |
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| Chemical Formula | C8H12NO+ |
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| Molecular Mass | 138.0913 |
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| SMILES | Cc1cc(CO)c[n+](C)c1 |
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| InChI Key | KTYNPISLLRBPFC-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 | aromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesn-methylpyridinium compoundsorganic cationsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aromatic alcoholalcoholn-methylpyridiniumaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compound |
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