| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:24 UTC |
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| Update Date | 2025-03-21 18:02:16 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00037156 |
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| Frequency | 94.9 |
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| Structure | |
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| Chemical Formula | C12H16N4O5 |
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| Molecular Mass | 296.1121 |
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| SMILES | Cn1c(=O)c2ncn(C3CC(O)C(CO)O3)c2n(C)c1=O |
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| InChI Key | REOCGBOSIFJXDH-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 2'-deoxyribonucleosides |
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| Direct Parent | purine 2'-deoxyribonucleosides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazoleslactamsmonosaccharidesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsprimary alcoholspurinonespyrimidonessecondary alcoholstetrahydrofuransureasvinylogous amides |
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| Substituents | lactammonosaccharidepyrimidoneimidazopyrimidinepurinonepyrimidineureasaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundprimary alcoholpurine 2'-deoxyribonucleosideorganoheterocyclic compoundazolen-substituted imidazolealcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativepurineorganic nitrogen compoundorganooxygen compound |
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