| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:21:19 UTC |
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| Update Date | 2025-03-21 18:37:00 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00113528 |
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| Frequency | 23.3 |
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| Structure | |
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| Chemical Formula | C6H8N2O3 |
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| Molecular Mass | 156.0535 |
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| SMILES | Cn1cc(C(=O)O)n(C)c1=O |
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| InChI Key | KEJXACDCOMURLL-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | carbonylimidazoles |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazolesmonocarboxylic acids and derivativesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsureasvinylogous amides |
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| Substituents | vinylogous amidecarbonyl groupcarbonic acid derivativecarboxylic acidaromatic heteromonocyclic compoundazacycleheteroaromatic compoundcarboxylic acid derivativeureaorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeimidazole-4-carbonyl grouporganic nitrogen compoundorganooxygen compoundn-substituted imidazole |
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