| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:42:03 UTC |
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| Update Date | 2025-03-24 20:51:48 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01591024 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H6N3O+ |
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| Molecular Mass | 136.0505 |
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| SMILES | O=c1[nH]c2cccc[n+]2[nH]1 |
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| InChI Key | VRGMTAQNFBYTJZ-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 | triazolopyridines |
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| Subclass | triazolopyridines |
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| Direct Parent | triazolopyridines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic carbonic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyridines and derivativestriazoles |
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| Substituents | triazolecarbonic acid derivative1,2,4-triazoleazacycleheteroaromatic compoundorganic oxidepyridinetriazolopyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cationorganooxygen compoundazole |
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