| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:18:33 UTC |
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| Update Date | 2025-03-21 18:35:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00106790 |
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| Frequency | 65.9 |
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| Structure | |
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| Chemical Formula | C6H4N4O4 |
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| Molecular Mass | 196.0233 |
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| SMILES | O=C(O)c1nc2[nH]c(=O)[nH]c2c(=O)[nH]1 |
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| InChI Key | DIICEFJOGZZACL-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 compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonocarboxylic acids and derivativesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrimidinecarboxylic acidspyrimidonesvinylogous amides |
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| Substituents | lactamcarboxylic acidpyrimidonecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolepyrimidine-2-carboxylic acidvinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundhypoxanthinehydrocarbon derivativeorganic nitrogen compoundpyrimidine-2-carboxylic acid or derivativesorganooxygen compound |
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