| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 12:22:00 UTC |
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| Update Date | 2025-03-24 21:36:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01829658 |
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| Frequency | 0.7 |
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| Structure | |
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| Chemical Formula | C5H7N3O2 |
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| Molecular Mass | 141.0538 |
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| SMILES | CC(=O)c1[nH]c(=O)[nH]c1N |
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| InChI Key | REYXSUNEQCLOFT-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 alkyl ketones |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonylimidazolesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsprimary aminesvinylogous amides |
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| Substituents | vinylogous amidecarbonic acid derivativearyl alkyl ketonearomatic heteromonocyclic compoundazacycleheteroaromatic compoundorganic oxideimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeimidazole-4-carbonyl groupprimary amineorganic nitrogen compoundamineorganoheterocyclic compoundazole |
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