| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:02 UTC |
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| Update Date | 2025-03-21 18:04:04 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048218 |
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| Frequency | 110.7 |
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| Structure | |
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| Chemical Formula | C6H5N5O |
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| Molecular Mass | 163.0494 |
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| SMILES | O=CNc1ncnc2nc[nH]c12 |
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| InChI Key | YHNZVIUHARVGLV-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 | purines and purine derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscarbonyl compoundscarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsn-arylamidesorganic oxidesorganopnictogen compoundspyrimidines and pyrimidine derivativessecondary carboxylic acid amides |
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| Substituents | carbonyl groupazacycleheteroaromatic compoundn-arylamidecarboxamide groupcarboxylic acid derivativepyrimidinesecondary carboxylic acid amideorganic oxideorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativepurineorganic nitrogen compoundimidolactamorganooxygen compoundazole |
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