| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:37:02 UTC |
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| Update Date | 2025-03-25 00:45:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02148869 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16NO+ |
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| Molecular Mass | 178.1226 |
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| SMILES | Cc1c(C)c2[n+](c(C)c1O)CCC2 |
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| InChI Key | WZDUWYJAYCXKQH-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 heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganic cationsorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundhydroxypyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cationorganooxygen compound |
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