| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 01:42:42 UTC |
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| Update Date | 2025-03-21 20:01:20 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00302663 |
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| Frequency | 6.5 |
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| Structure | |
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| Chemical Formula | C5H4N2O2 |
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| Molecular Mass | 124.0273 |
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| SMILES | O=CC(=O)c1c[nH]cn1 |
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| InChI Key | NDFBGSMILLNVFR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic oxygen compounds |
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| Class | organooxygen compounds |
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| Subclass | carbonyl compounds |
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| Direct Parent | aryl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | alpha ketoaldehydesazacyclic compoundscarbonylimidazolesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsvinylogous amides |
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| Substituents | vinylogous amidearomatic heteromonocyclic compoundazacycleheteroaromatic compoundaldehydeorganic oxideimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeimidazole-4-carbonyl grouporganic nitrogen compoundalpha-ketoaldehydeorganoheterocyclic compoundaryl ketoneazole |
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