| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:51:45 UTC |
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| Update Date | 2025-03-21 18:03:11 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00042712 |
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| Frequency | 79.9 |
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| Structure | |
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| Chemical Formula | C10H7NO2 |
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| Molecular Mass | 173.0477 |
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| SMILES | CC1=CC(=O)c2ncccc2C1=O |
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| InChI Key | XXQAHBXLRFWCTG-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 | quinoline quinones |
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| Direct Parent | quinoline quinones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl ketonesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativesmethylpyridinesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | quinoline quinoneazacyclepolyhalopyridineheteroaromatic compoundmethylpyridineketoneorganic oxidepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganooxygen compoundaryl ketone |
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