| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:03:45 UTC |
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| Update Date | 2025-03-25 01:17:40 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02348076 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C24H33N10O19P3S |
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| Molecular Mass | 890.0857 |
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| SMILES | Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OP(=O)(O)OCC2OC(n3cnc4c(=O)[nH]c(SCCC(N)C(=O)O)nc43)C(O)C2O)C(O)C1O |
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| InChI Key | ZSGUNSFWLGIUKZ-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 | purine nucleotides |
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| Subclass | purine ribonucleotides |
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| Direct Parent | purine ribonucleoside triphosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | alkylarylthioethersalpha amino acidsamino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsfatty acylsheteroaromatic compoundshydrocarbon derivativeshydroxy fatty acidshypoxanthinesimidazolesimidolactamslactamsmonoalkyl phosphatesmonoalkylaminesmonocarboxylic acids and derivativesmonosaccharidesn-substituted imidazolesorganic oxidesorganopnictogen compoundsoxacyclic compoundspentose phosphatespurine ribonucleoside monophosphatespurines and purine derivativespyrimidonessecondary alcoholssulfenyl compoundstetrahydrofuransthia fatty acidsvinylogous amides |
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| Substituents | lactamcarboxylic acidamino acid or derivativespurine ribonucleoside monophosphatemonosaccharidepentose-5-phosphatealpha-amino acid or derivativesimidazopyrimidinearyl thioethersaccharideorganonitrogen compoundalpha-amino acidhydroxy fatty acidpurine ribonucleoside triphosphateorganoheterocyclic compoundalcoholvinylogous amidesulfenyl compoundazacycleheteroaromatic compoundthioethermonoalkyl phosphatehypoxanthinehydrocarbon derivativeprimary aliphatic amineprimary amineaminefatty acylcarbonyl grouppentose phosphateamino acidpyrimidonealkylarylthioetherorganosulfur compoundcarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganopnictogen compoundimidolactamazolen-substituted imidazoletetrahydrofuranoxacyclemonocarboxylic acid or derivativesthia fatty acidorganic oxygen compoundphosphoric acid estersecondary alcoholpurineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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