| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 16:38:07 UTC |
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| Update Date | 2025-03-25 01:30:43 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02427558 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C24H34N9O21P3 |
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| Molecular Mass | 877.1082 |
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| SMILES | Nc1ncnc2c1ncn2C1OC(COP(=O)(O)OP(=O)(O)OCC2OC(n3cnc(C(=O)NC(CC(=O)O)CC(=O)O)c3N)C(O)C2O)C(O)C1OP(=O)(O)O |
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| InChI Key | BBWUHJFBPQBLHG-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 diphosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-ribosyl-imidazolecarboxamides2-heteroaryl carboxamidesamino acidsazacyclic compoundsbeta amino acids and derivativescarbonyl compoundscarbonylimidazolescarboxylic acidsdicarboxylic acids and derivativesheteroaromatic compoundshydrocarbon derivativesimidazolesimidolactamsmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary aminespurine ribonucleoside 2',5'-bisphosphatespurines and purine derivativespyrimidines and pyrimidine derivativessecondary alcoholssecondary carboxylic acid amidestetrahydrofuransvinylogous amides |
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| Substituents | carboxylic acidamino acid or derivativesmonosaccharidepentose-5-phosphateimidazopyrimidine2-heteroaryl carboxamidesaccharidepurine ribonucleoside diphosphatepurine ribonucleoside 2',5'-bisphosphateorganonitrogen compoundorganoheterocyclic compoundalcoholvinylogous amideazacycleheteroaromatic compoundorganic pyrophosphatesecondary carboxylic acid amidemonoalkyl phosphatedicarboxylic acid or derivativeshydrocarbon derivativeprimary amineaminecarbonyl groupimidazole ribonucleosidepentose phosphateamino acidcarboxylic acid derivativepyrimidineorganic oxidearomatic heteropolycyclic compoundimidazoleorganopnictogen compoundimidazole-4-carbonyl groupimidolactamazolen-substituted imidazoletetrahydrofurancarboxamide groupbeta amino acid or derivatives1-ribosyl-imidazolecarboxamideoxacycleorganic oxygen compoundphosphoric acid estersecondary alcoholpurineorganic nitrogen compoundorganic phosphoric acid derivativealkyl phosphateorganooxygen compound |
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