| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:01:17 UTC |
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| Update Date | 2025-03-25 00:54:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02204172 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C9H6INO |
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| Molecular Mass | 270.9494 |
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| SMILES | Oc1cc2cccnc2cc1I |
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| InChI Key | XJMLLIVTKBBPCU-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 | hydroxyquinolines |
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| Direct Parent | hydroxyquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesaryl iodidesazacyclic compoundsbenzenoidshaloquinolinesheteroaromatic compoundshydrocarbon derivativeshydroxypyridineso-iodophenolsorganoiodidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | polyhalopyridine1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundorganoiodidehaloquinolinearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundhydroxypyridine2-iodophenolaryl halidehydroxyquinolinepyridineorganic oxygen compoundhydrocarbon derivativebenzenoidaryl iodideorganic nitrogen compoundorganooxygen compound |
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