| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:47 UTC |
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| Update Date | 2025-03-25 00:47:09 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02159735 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H13N6O8P |
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| Molecular Mass | 400.0532 |
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| SMILES | O=c1[nH]cnc2nc3ncn(C4OC(COP(=O)(O)O)C(O)C4O)c3nc12 |
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| InChI Key | ZEYQNINAIIZAIW-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 | organooxygen compounds |
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| Subclass | carbohydrates and carbohydrate conjugates |
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| Direct Parent | pentose phosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1,2-diolsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesimidazopyrazineslactamsmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspteridines and derivativespyrazinespyrimidonessecondary alcoholstetrahydrofurans |
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| Substituents | lactamimidazopyrazinepentose phosphatepentose-5-phosphatepyrimidonepteridinepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazole1,2-dioln-substituted imidazolealcoholazacycletetrahydrofuranheteroaromatic compoundoxacyclephosphoric acid estermonoalkyl phosphatepyrazinesecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphate |
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