| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:41:58 UTC |
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| Update Date | 2025-03-25 00:47:12 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02160125 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C15H26N3O18P3 |
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| Molecular Mass | 629.0424 |
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| SMILES | Nc1ccn(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(CO)C(O)C3O)C(O)C2OP(=O)(O)O)c(=O)n1 |
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| InChI Key | KIKKLHKCQOXEBK-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 | pyrimidine nucleotides |
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| Subclass | pyrimidine ribonucleotides |
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| Direct Parent | pyrimidine ribonucleoside 2',5'-bisphosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | azacyclic compoundsdialkyl ethersheteroaromatic compoundshydrocarbon derivativesimidolactamsmonoalkyl phosphatesmonosaccharidesorganic carbonic acids and derivativesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundspentose phosphatesprimary alcoholsprimary aminespyrimidine nucleosidespyrimidonessecondary alcoholstetrahydrofurans |
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| Substituents | etheraromatic heteromonocyclic compoundpentose phosphatemonosaccharidepentose-5-phosphatepyrimidonedialkyl etherpyrimidinepyrimidine ribonucleoside 2',5'-bisphosphatesaccharideorganic oxideorganonitrogen compoundorganopnictogen compoundpyrimidine nucleosideprimary alcoholimidolactamorganoheterocyclic compoundalcoholcarbonic acid derivativeazacycletetrahydrofuranheteroaromatic compoundorganic pyrophosphateoxacycleorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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