| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:36:41 UTC |
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| Update Date | 2025-03-21 18:46:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00149527 |
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| Frequency | 16.3 |
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| Structure | |
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| Chemical Formula | C7H10NO2+ |
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| Molecular Mass | 140.0706 |
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| SMILES | COc1cc[n+](C)cc1O |
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| InChI Key | SIFONHJHUYHSEZ-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 | alkyl aryl ethersazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesn-methylpyridinium compoundsorganic cationsorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | ethern-methylpyridiniumaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinemethylpyridinealkyl aryl etherorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compound |
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