| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:58:35 UTC |
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| Update Date | 2025-03-21 18:05:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00058820 |
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| Frequency | 53.6 |
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| Structure | |
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| Chemical Formula | C11H16N4O9P2 |
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| Molecular Mass | 410.0393 |
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| SMILES | Nc1ncnc2c1ccn2C1CC(O)C(COP(=O)(O)OP(=O)(O)O)O1 |
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| InChI Key | PYSINQSNHAOMKT-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 | pyrrolopyrimidine nucleosides and nucleotides |
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| Subclass | pyrrolopyrimidine nucleosides and nucleotides |
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| Direct Parent | pyrrolopyrimidine nucleosides and nucleotides |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesmonosaccharidesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary aminespyrimidines and pyrimidine derivativespyrrolo[2,3-d]pyrimidinessecondary alcoholssubstituted pyrrolestetrahydrofurans |
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| Substituents | pentose phosphatemonosaccharidesubstituted pyrrolepyrimidinepyrrolopyrimidinesaccharideorganic oxidepyrrolo[2,3-d]pyrimidinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundimidolactamorganoheterocyclic compoundalcoholazacycletetrahydrofuranheteroaromatic compoundpyrrolopyrimidine ribonucleosideorganic pyrophosphateoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatepyrrolesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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