| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:11:53 UTC |
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| Update Date | 2025-03-21 18:32:21 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00090478 |
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| Frequency | 31.1 |
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| Structure | |
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| Chemical Formula | C12H11NO |
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| Molecular Mass | 185.0841 |
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| SMILES | CC(=O)c1cc2ccccc2nc1C |
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| InChI Key | OKDWGFQXJYJNIJ-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 | quinolines and derivatives |
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| Direct Parent | quinolines and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl alkyl ketonesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | aryl alkyl ketoneazacyclepolyhalopyridineheteroaromatic compoundmethylpyridineketoneorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundquinolineorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganooxygen compoundaryl ketone |
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