| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:17 UTC |
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| Update Date | 2025-03-25 00:47:18 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160790 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15N5O6 |
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| Molecular Mass | 313.1022 |
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| SMILES | Nc1nc2c(O)nc(=O)n(C3CC(O)C(O)C(CO)O3)c2[nH]1 |
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| InChI Key | CBBFEJQJJAWJHO-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 derivativeshydroxypyrimidinesimidazolesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary alcoholsprimary aminespurinonespyrimidonessecondary alcohols |
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| Substituents | monosaccharidepyrimidonehydroxypyrimidinepurinonepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundoxaneprimary alcoholazolealcoholcarbonic acid derivativeazacycleheteroaromatic compoundxanthineoxacyclealkaloid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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