| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:42:35 UTC |
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| Update Date | 2025-03-25 00:47:24 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02161488 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C6H7ClN2 |
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| Molecular Mass | 142.0298 |
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| SMILES | NCc1ccc(Cl)nc1 |
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| InChI Key | XPARFBOWIYMLMY-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 derivativesmonoalkylaminesorganochloridesorganonitrogen compoundsorganopnictogen compoundspyridines and derivatives |
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| Substituents | aryl chloridearomatic heteromonocyclic compoundazacyclepolyhalopyridineorganochlorideheteroaromatic compoundorganohalogen compoundaryl halideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amine2-halopyridineorganic nitrogen compound |
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