Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:19:11 UTC |
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Update Date | 2025-03-21 18:36:00 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00108345 |
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Frequency | 24.7 |
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Structure | |
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Chemical Formula | C8H15N3O9P2 |
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Molecular Mass | 359.0284 |
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SMILES | Nc1cncn1C1CC(O)C(COP(=O)(O)OP(=O)(O)O)O1 |
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InChI Key | RRPYIQLVGFEAFH-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 heteromonocyclic compounds |
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Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesimidazolesmonoalkyl phosphatesmonosaccharidesn-substituted imidazolesorganic oxidesorganic pyrophosphatesorganopnictogen compoundsoxacyclic compoundsprimary aminessecondary alcoholstetrahydrofurans |
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Substituents | aromatic heteromonocyclic compoundpentose phosphateorganic oxideimidazoleorganonitrogen compoundorganopnictogen compoundorganoheterocyclic compoundazolen-substituted imidazolealcoholazacycletetrahydrofuranheteroaromatic compoundorganic pyrophosphateoxacyclephosphoric acid estermonoalkyl phosphatesecondary alcoholhydrocarbon derivativeprimary amineorganic nitrogen compoundorganic phosphoric acid derivativeaminealkyl phosphate |
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