| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:07:42 UTC |
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| Update Date | 2025-03-25 00:56:33 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02219151 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C16H11NO |
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| Molecular Mass | 233.0841 |
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| SMILES | COc1ccc2ccc3cccc4ncc1c2c34 |
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| InChI Key | PLCBIYGAUUZJMK-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 | benzoquinolines |
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| Direct Parent | phenanthridines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalkyl aryl ethersanisolesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesisoquinolines and derivativesmethylpyridinesnaphthalenesorganonitrogen compoundsorganopnictogen compoundsphenanthrenes and derivativespolyhalopyridines |
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| Substituents | phenol etheretherpolyhalopyridinealkyl aryl etheraromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinephenanthreneazacycleheteroaromatic compoundmethylpyridinepyridinenaphthaleneorganic oxygen compoundanisoleisoquinolinehydrocarbon derivativebenzenoidphenanthridineorganic nitrogen compoundorganooxygen compound |
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