Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:17:33 UTC |
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Update Date | 2025-03-21 18:35:11 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00104349 |
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Frequency | 26.0 |
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Structure | |
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Chemical Formula | C11H17N5O10P2 |
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Molecular Mass | 441.0451 |
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SMILES | Nc1ncnc2c1ncn2C1CC(O)C(O)C(COP(=O)(O)OP(=O)(O)O)O1 |
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InChI Key | MAGIZCITGLYALY-UHFFFAOYSA-N |
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Chemical Taxonomy |
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Kingdom | organic compounds |
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Superclass | organic oxygen compounds |
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Class | organic oxoanionic compounds |
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Subclass | organic pyrophosphates |
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Direct Parent | organic pyrophosphates |
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Geometric Descriptor | aromatic heteropolycyclic compounds |
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Alternative Parents | 1,2-diolsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundsoxanesprimary aminespurines and purine derivativespyrimidines and pyrimidine derivativessecondary alcohols |
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Substituents | monosaccharideimidazopyrimidinepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundoxaneimidolactamorganoheterocyclic compoundazole1,2-dioln-substituted imidazolealcoholazacycleheteroaromatic compoundorganic pyrophosphateoxacyclephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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