| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:04:23 UTC |
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| Update Date | 2025-03-21 18:28:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00072652 |
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| Frequency | 80.7 |
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| Structure | |
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| Chemical Formula | C7H5N3O2 |
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| Molecular Mass | 163.0382 |
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| SMILES | O=c1ccc2[nH]cnc2c(=O)[nH]1 |
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| InChI Key | JCLUTJDEFXLDGC-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 | azepines |
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| Subclass | azepines |
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| Direct Parent | azepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidelactamazacycleheteroaromatic compoundorganic oxideazepineorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazole |
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