| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:53:08 UTC |
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| Update Date | 2025-03-21 18:03:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00046063 |
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| Frequency | 110.8 |
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| Structure | |
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| Chemical Formula | C5H7N3O |
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| Molecular Mass | 125.0589 |
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| SMILES | CNC(=O)c1cnc[nH]1 |
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| InChI Key | FLFMCBMWUDAGSD-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | carboxylic acid derivatives |
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| Direct Parent | 2-heteroaryl carboxamides |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarbonylimidazolescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundssecondary carboxylic acid amides |
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| Substituents | carbonyl grouparomatic heteromonocyclic compoundazacycleheteroaromatic compound2-heteroaryl carboxamidesecondary carboxylic acid amideorganic oxideorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeimidazole-4-carbonyl grouporganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundazole |
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