| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:59 UTC |
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| Update Date | 2025-03-25 00:57:01 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02222125 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H8FN3O |
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| Molecular Mass | 229.0651 |
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| SMILES | Oc1ccc2nc(-c3ccc(F)cc3)[nH]c2n1 |
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| InChI Key | NXTNCUNGADSIOW-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 | azoles |
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| Subclass | imidazoles |
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| Direct Parent | phenylimidazoles |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl fluoridesazacyclic compoundsfluorobenzenesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesimidazolesimidazopyridinesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridines |
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| Substituents | aryl fluoridemonocyclic benzene moietypolyhalopyridineimidazopyridineorganohalogen compoundfluorobenzenearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleorganofluorideheteroaromatic compoundhydroxypyridinearyl halidepyridineorganic oxygen compound2-phenylimidazolehydrocarbon derivativebenzenoidorganic nitrogen compoundhalobenzeneorganooxygen compound |
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