| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:14:17 UTC |
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| Update Date | 2025-03-21 18:33:32 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00096305 |
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| Frequency | 35.9 |
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| Structure | |
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| Chemical Formula | C10H6N2O |
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| Molecular Mass | 170.048 |
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| SMILES | N#Cc1ccc2nc(O)ccc2c1 |
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| InChI Key | WXORYMJWFSZLIB-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 | quinolones and derivatives |
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| Direct Parent | quinolones and derivatives |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesnitrilesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | quinolonenitrileazacyclepolyhalopyridineheteroaromatic compoundhydroxypyridinepyridineorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoid2-halopyridineorganic nitrogen compoundcarbonitrileorganooxygen compound |
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