| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:21:10 UTC |
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| Update Date | 2025-03-25 01:01:31 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02249790 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H13N3O |
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| Molecular Mass | 227.1059 |
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| SMILES | Cc1cc2cc3[nH]c(=O)n(C)c3nc2cc1C |
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| InChI Key | SCKMCIQERJIWOM-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-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesimidazolesimidazopyridinesmethylpyridinesn-substituted imidazolesorganic carbonic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | carbonic acid derivativeazacyclepolyhalopyridineheteroaromatic compoundmethylpyridineimidazopyridineorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundimidazoleorganonitrogen compoundquinolineorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundorganooxygen compoundazolen-substituted imidazole |
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