| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:13:26 UTC |
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| Update Date | 2025-03-21 18:33:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00094239 |
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| Frequency | 43.4 |
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| Structure | |
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| Chemical Formula | C8H13N2O4PS |
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| Molecular Mass | 264.0334 |
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| SMILES | Cc1ncc(COP(O)(O)=S)c(CN)c1O |
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| InChI Key | FLLPLSLNYOOCAP-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-halopyridinesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonoalkylaminesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinesthiophosphate monoesters |
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| Substituents | aromatic heteromonocyclic compoundazacyclepolyhalopyridinethiophosphoric acid esterheteroaromatic compoundhydroxypyridinethiophosphate monoesterorganic thiophosphoric acid or derivativespyridoxamine 5'-phosphateorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amine2-halopyridineorganic nitrogen compoundorganooxygen compound |
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