Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-20 23:40:54 UTC |
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Update Date | 2025-03-21 17:58:53 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00017334 |
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Frequency | 558.3 |
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Structure | |
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Chemical Formula | C11H13N5O7 |
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Molecular Mass | 327.0815 |
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SMILES | Nc1nc2c(c(O)nc(=O)n2C2OC(CO)C(O)C2O)c(=O)[nH]1 |
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InChI Key | CDQLPIUKUBLZNJ-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 | diazines |
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Subclass | pyrimidines and pyrimidine derivatives |
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Direct Parent | pyrimidones |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyrimidineslactamsmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganopnictogen compoundsoxacyclic compoundsprimary alcoholsprimary aminessecondary alcoholstetrahydrofuransvinylogous acidsvinylogous amides |
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Substituents | lactammonosaccharidepyrimidonehydroxypyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundprimary alcoholalcoholvinylogous amidecarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundoxacyclevinylogous acidorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundamineorganooxygen compound |
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