| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:55 UTC |
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| Update Date | 2025-03-25 00:53:15 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02198751 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C13H10FNO6 |
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| Molecular Mass | 295.0492 |
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| SMILES | O=C(O)c1cn(CC(O)C(=O)O)c2ccc(F)cc2c1=O |
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| InChI Key | PLIOONIHBSBIGP-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 carboxylic acids |
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| Direct Parent | quinoline carboxylic acids |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 2-halopyridinesalpha hydroxy acids and derivativesaryl fluoridesazacyclic compoundsbenzenoidscarbonyl compoundscarboxylic acidsdicarboxylic acids and derivativesfluoroquinoloneshaloquinolinesheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneshydroxypyridinesorganic oxidesorganofluoridesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridine-3-carboxylic acidssecondary alcoholsvinylogous amides |
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| Substituents | aryl fluoridepyridine carboxylic acid or derivativescarbonyl groupcarboxylic acidpyridine-3-carboxylic acidpolyhalopyridinealpha-hydroxy acidcarboxylic acid derivativeorganohalogen compoundquinoline-3-carboxylic acidhaloquinolineorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundfluoroquinolone2-halopyridinealcoholvinylogous amideazacycleorganofluorideheteroaromatic compoundhydroxypyridinedihydroquinolinehydroxy acidaryl halidedihydroquinolonepyridineorganic oxygen compoundpyridine carboxylic acidsecondary alcoholdicarboxylic acid or derivativeshydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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