| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:44:04 UTC |
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| Update Date | 2025-03-21 17:59:59 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00024465 |
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| Frequency | 174.3 |
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| Structure | |
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| Chemical Formula | C5H4N4O3 |
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| Molecular Mass | 168.0283 |
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| SMILES | O=c1[nH]c(=O)c2c(=O)[nH][nH]c2[nH]1 |
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| InChI Key | MQFMTHKKUARNNI-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 | xanthines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkaloids and derivativesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeslactamsorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspyrazolespyrazolo[3,4-d]pyrimidinespyrazolonespyrimidonesvinylogous amides |
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| Substituents | pyrazolo[3,4-d]pyrimidinevinylogous amidecarbonic acid derivativelactamazacycleheteroaromatic compoundpyrimidonexanthinepyrazolepyrimidineorganic oxidealkaloid or derivativespyrazolopyrimidineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundazolepyrazolinone |
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