| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:20:35 UTC |
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| Update Date | 2025-03-25 01:01:19 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02248419 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6HCl3N2O |
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| Molecular Mass | 221.9154 |
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| SMILES | N#Cc1c(O)c(Cl)nc(Cl)c1Cl |
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| InChI Key | XVHSOSOECYEHON-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-halopyridinesaryl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesnitrilesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | aryl chloridenitrilearomatic heteromonocyclic compoundazacyclepolyhalopyridineorganochlorideheteroaromatic compoundhydroxypyridineorganohalogen compoundaryl halideorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundcarbonitrileorganooxygen compound |
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