Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:53:13 UTC |
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Update Date | 2025-03-25 00:51:16 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02185818 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C8H7N5O4 |
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Molecular Mass | 237.0498 |
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SMILES | Nc1nc2c([nH]c(=O)n2C=CC(=O)O)c(=O)[nH]1 |
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InChI Key | FBNPQQWQSYHCAG-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 | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonocarboxylic acids and derivativesn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsprimary aminespyrimidonesvinylogous amides |
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Substituents | carbonyl grouplactamcarboxylic acidamino acid or derivativesamino acidpyrimidonecarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolen-substituted imidazolevinylogous amidecarbonic acid derivativeazacycleheteroaromatic compoundmonocarboxylic acid or derivativesorganic oxygen compoundhypoxanthinehydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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