| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 05:05:03 UTC |
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| Update Date | 2025-03-24 14:11:03 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00782672 |
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| Frequency | 1.9 |
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| Structure | |
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| Chemical Formula | C6H5N3O |
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| Molecular Mass | 135.0433 |
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| SMILES | O=c1cc2cn[nH]c2c[nH]1 |
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| InChI Key | XCRKRGZMCITMSL-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 | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrazolespyridines and derivativespyridinones |
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| Substituents | lactamazacyclepolyhalopyridineheteroaromatic compoundpyrazoleorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundpyridinoneorganooxygen compoundazole |
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