| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:04:30 UTC |
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| Update Date | 2025-03-21 18:28:36 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00072966 |
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| Frequency | 40.9 |
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| Structure | |
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| Chemical Formula | C8H8N4O4 |
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| Molecular Mass | 224.0546 |
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| SMILES | Cn1c(=O)c(=O)[nH]c(=O)c2c1[nH]c(=O)n2C |
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| InChI Key | HGUMCYIJWGXWRC-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 | diazepines |
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| Subclass | 1,4-diazepines |
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| Direct Parent | 1,4-diazepines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativelactamazacycleheteroaromatic compoundorganic oxidepara-diazepineorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazolen-substituted imidazole |
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