| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:44:13 UTC |
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| Update Date | 2025-03-21 18:49:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00167473 |
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| Frequency | 20.7 |
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| Structure | |
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| Chemical Formula | C6H5N3 |
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| Molecular Mass | 119.0483 |
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| SMILES | c1cc2cn[nH]c2cn1 |
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| InChI Key | KNYHISBJRQVMAZ-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 derivativesorganonitrogen compoundsorganopnictogen compoundspyrazolespyridines and derivatives |
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| Substituents | azacyclepolyhalopyridineheteroaromatic compoundpyrazolearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundazole |
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