| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:17:53 UTC |
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| Update Date | 2025-03-25 00:38:35 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02104386 |
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| Frequency | 0.6 |
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| Structure | |
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| Chemical Formula | C4H4N2O3 |
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| Molecular Mass | 128.0222 |
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| SMILES | O=C(O)Cc1cnno1 |
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| InChI Key | KUBGBMWKCNZWEM-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 | heteroaromatic compounds |
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| Subclass | heteroaromatic compounds |
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| Direct Parent | heteroaromatic compounds |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 1,2,3-oxadiazolesazacyclic compoundscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compounds |
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| Substituents | carbonyl groupcarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundcarboxylic acid derivativeoxacycleorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compound1,2,3-oxadiazoleoxadiazoleorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazole |
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