| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:18:14 UTC |
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| Update Date | 2025-03-24 20:41:50 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01534013 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C7H8N2O |
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| Molecular Mass | 136.0637 |
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| SMILES | OC1CNc2cccnc21 |
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| InChI Key | XRNTYBSQQNEXML-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 heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganopnictogen compoundssecondary alcoholssecondary alkylarylamines |
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| Substituents | alcoholazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinesecondary aminesecondary aliphatic/aromatic amineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundamineorganooxygen compound |
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