| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:03:23 UTC |
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| Update Date | 2025-03-25 00:54:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02209019 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H11N5O2 |
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| Molecular Mass | 221.0913 |
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| SMILES | CC(C)C(=O)n1cnc2c(=O)[nH]c(N)nc21 |
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| InChI Key | VTHKSGXIBFMSFO-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 | hypoxanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarbonylimidazolesheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsn-acylimidazolesorganic oxidesorganopnictogen compoundsprimary aminespurines and purine derivativespyrimidonesvinylogous amides |
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| Substituents | carbonyl grouplactampyrimidonepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolevinylogous amideimidazole-1-carbonyl groupazacycleheteroaromatic compoundorganic oxygen compoundn-acylimidazolehypoxanthinehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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