| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:49:59 UTC |
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| Update Date | 2025-03-21 18:02:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00038522 |
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| Frequency | 90.8 |
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| Structure | |
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| Chemical Formula | C9H6ClNO |
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| Molecular Mass | 179.0138 |
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| SMILES | Oc1ccnc2ccc(Cl)cc12 |
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| InChI Key | XXGUQCVVGPZTPF-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 | quinolines and derivatives |
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| Subclass | haloquinolines |
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| Direct Parent | haloquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl chloridesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesorganochloridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | aryl chlorideazacyclepolyhalopyridineorganochlorideheteroaromatic compoundhydroxypyridineorganohalogen compoundaryl halidehaloquinolinepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganooxygen compound |
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