| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:24:03 UTC |
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| Update Date | 2025-03-21 18:38:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00120106 |
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| Frequency | 21.7 |
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| Structure | |
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| Chemical Formula | C6H7N5O2 |
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| Molecular Mass | 181.06 |
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| SMILES | Nc1nc(=O)c2c([nH]1)NCN2C=O |
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| InChI Key | KRMQWSHBBRZJMA-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 | imidazopyrimidines |
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| Subclass | purines and purine derivatives |
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| Direct Parent | purinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | amino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary aminespyrimidonessecondary alkylarylaminestertiary carboxylic acid amidesvinylogous amides |
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| Substituents | carbonyl groupamino acid or derivativespyrimidonecarboxylic acid derivativepurinonepyrimidineorganic oxidearomatic heteropolycyclic compoundtertiary carboxylic acid amideorganonitrogen compoundorganopnictogen compoundvinylogous amideazacycleheteroaromatic compoundsecondary aminecarboxamide groupsecondary aliphatic/aromatic amineorganic oxygen compoundhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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