| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:56 UTC |
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| Update Date | 2025-03-25 00:50:45 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02182935 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C10H6F3NO2 |
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| Molecular Mass | 229.0351 |
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| SMILES | O=c1cc(C(F)(F)F)c2ccc(O)cc2[nH]1 |
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| InChI Key | XAGSNZIBWDMNBS-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 | hydroquinolones |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesalkyl fluoridesazacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroxypyridineslactamsorganic oxidesorganofluoridesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridinones |
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| Substituents | lactampolyhalopyridine1-hydroxy-2-unsubstituted benzenoidorganohalogen compoundorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundalkyl halide2-halopyridineazacyclealkyl fluorideorganofluorideheteroaromatic compoundhydroxypyridinedihydroquinolinedihydroquinolonepyridineorganic oxygen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compound |
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