| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:43:30 UTC |
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| Update Date | 2025-03-21 17:59:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00023129 |
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| Frequency | 223.9 |
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| Structure | |
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| Chemical Formula | C11H14N4O7 |
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| Molecular Mass | 314.0862 |
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| SMILES | Cn1c(=O)[nH]c2c([nH]c(=O)n2C2OC(CO)C(O)C2O)c1=O |
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| InChI Key | PEBODCYRDPQQFR-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | nucleosides, nucleotides, and analogues |
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| Class | purine nucleosides |
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| Subclass | purine nucleosides |
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| Direct Parent | purine nucleosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonosaccharidesn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspurinonespyrimidonessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | lactammonosaccharidepyrimidoneimidazopyrimidinepurinonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundprimary alcoholorganoheterocyclic compoundazolen-substituted imidazolealcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranpurine nucleosideheteroaromatic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativepurineorganic nitrogen compoundorganooxygen compound |
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