| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:14:45 UTC |
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| Update Date | 2025-03-25 00:59:05 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02235024 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C14H22N2O6 |
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| Molecular Mass | 314.1478 |
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| SMILES | Cc1ncc(COC2OC(C)C(O)C(O)C2O)c(CN)c1O |
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| InChI Key | WRQVXWMYINHALY-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organoheterocyclic compounds |
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| Class | pyridines and derivatives |
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| Subclass | pyridoxamines |
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| Direct Parent | pyridoxamine 5'-phosphates |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesacetalsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesmonoalkylaminesmonosaccharidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundsoxanespolyhalopyridinessecondary alcohols |
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| Substituents | aromatic heteromonocyclic compoundpolyhalopyridinemonosaccharidesaccharideacetalorganonitrogen compoundorganopnictogen compound2-halopyridineoxanealcoholazacycleheteroaromatic compoundhydroxypyridinemethylpyridinepyridoxamine 5'-phosphateoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compoundorganooxygen compound |
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