Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:31:25 UTC |
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Update Date | 2025-03-21 18:42:01 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00137331 |
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Frequency | 18.2 |
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Structure | |
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Chemical Formula | C8H12N2O3 |
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Molecular Mass | 184.0848 |
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SMILES | Cc1nc(CO)c(O)c(CN)c1O |
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InChI Key | CDCJAMHDHDUNKK-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 | halopyridines |
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Direct Parent | polyhalopyridines |
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Geometric Descriptor | aromatic heteromonocyclic compounds |
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Alternative Parents | 2-halopyridinesaromatic alcoholsazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonoalkylaminesorganonitrogen compoundsorganopnictogen compounds |
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Substituents | aromatic alcoholalcoholaromatic heteromonocyclic compoundazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridineorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amine2-halopyridineorganic nitrogen compoundorganooxygen compound |
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