| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 10:28:02 UTC |
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| Update Date | 2025-03-24 20:46:06 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID01557736 |
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| Frequency | 0.8 |
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| Structure | |
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| Chemical Formula | C6H4ClNO |
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| Molecular Mass | 140.9981 |
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| SMILES | O=C(Cl)c1ccccn1 |
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| InChI Key | PSAYJRPASWETSH-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 | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesacyl chloridesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic oxidesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
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| Substituents | pyridine carboxylic acid or derivativesaromatic heteromonocyclic compoundazacycleorganochlorideheteroaromatic compoundorganohalogen compoundacyl halideorganic oxideorganic oxygen compoundacyl chlorideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compound |
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