| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:59 UTC |
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| Update Date | 2025-03-25 00:46:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02153435 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H13NO4 |
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| Molecular Mass | 283.0845 |
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| SMILES | COc1ccc2c(c1)cc(O)c(-c1ccc(O)cc1)[n+]2[O-] |
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| InChI Key | CXUZFNONUUPBQC-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 | phenylquinolines |
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| Direct Parent | phenylquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsbenzene and substituted derivativesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | phenol ethermonocyclic benzene moietyetherphenylquinolinepolyhalopyridine1-hydroxy-2-unsubstituted benzenoidalkyl aryl etherorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundhydroxypyridinemethylpyridinepyridineorganic oxygen compoundanisolephenolhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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