| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:53:08 UTC |
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| Update Date | 2025-03-25 00:51:14 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02185613 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C20H26N6O14P2 |
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| Molecular Mass | 636.0982 |
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| SMILES | Nc1ncnc2c1ncn2C1OC(CO)C(OP(=O)(O)OP(=O)(O)OCC2OC(n3ccc(=O)cc3)C(O)C2O)C1O |
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| InChI Key | JWWGIUNIPQGAKZ-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 | ribonucleoside 3'-phosphates |
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| Subclass | ribonucleoside 3'-phosphates |
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| Direct Parent | ribonucleoside 3'-phosphates |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | azacyclic compoundscyclic ketonesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesimidazolesimidolactamsmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary alcoholsprimary aminespurines and purine derivativespyrimidines and pyrimidine derivativessecondary alcoholstetrahydrofuransvinylogous amides |
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| Substituents | pentose phosphatemonosaccharidepentose-5-phosphatecyclic ketoneimidazopyrimidinepyrimidinesaccharideorganic oxidearomatic heteropolycyclic compoundimidazoleorganonitrogen compoundorganopnictogen compoundprimary alcoholimidolactamorganoheterocyclic compoundazolen-substituted imidazoleribonucleoside 3'-phosphatealcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridineorganic pyrophosphateoxacyclepyridineorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary aminepurineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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