| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 03:08:18 UTC |
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| Update Date | 2025-03-21 22:10:25 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00505023 |
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| Frequency | 3.4 |
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| Structure | |
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| Chemical Formula | C5H8N4O |
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| Molecular Mass | 140.0698 |
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| SMILES | CNc1ncc(C(N)=O)[nH]1 |
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| InChI Key | RMURQWGMUWNPAS-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 | amino acids and derivativesazacyclic compoundscarbonyl compoundscarbonylimidazolescarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amidessecondary alkylarylamines |
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| Substituents | primary carboxylic acid amidecarbonyl grouparomatic heteromonocyclic compoundazacycleamino acid or derivativesheteroaromatic compoundsecondary amine2-heteroaryl carboxamidesecondary aliphatic/aromatic amineorganic oxideorganic oxygen compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeimidazole-4-carbonyl grouporganic nitrogen compoundorganoheterocyclic compoundorganooxygen compoundamineazole |
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