| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:22:00 UTC |
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| Update Date | 2025-03-25 01:01:47 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02251692 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C5H3N5O3 |
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| Molecular Mass | 181.0236 |
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| SMILES | O=Nc1nc2[nH]c(=O)[nH]c(=O)c2[nH]1 |
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| InChI Key | JWHSIAIUHUPHJX-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 | purinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsc-nitroso compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsorganic carbonic acids and derivativesorganic oxidesorganooxygen compoundsorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrimidonesvinylogous amides |
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| Substituents | lactampyrimidonepurinonepyrimidinepropargyl-type 1,3-dipolar organic compoundorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundazolevinylogous amideorganic nitroso compoundcarbonic acid derivativeazacycleheteroaromatic compoundorganic 1,3-dipolar compoundorganic oxygen compoundc-nitroso compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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