| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:51:07 UTC |
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| Update Date | 2025-03-25 00:50:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02181100 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H9NO6 |
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| Molecular Mass | 263.043 |
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| SMILES | O=C(O)CC(=O)c1c(O)c2cc(O)ccc2[nH]c1=O |
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| InChI Key | RFTSKYUEZGFLIO-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 | hydroxyquinolines |
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| Direct Parent | hydroxyquinolines |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesaryl alkyl ketonesazacyclic compoundsbenzenoidsbeta-hydroxy ketonesbeta-keto acids and derivativescarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneshydroxypyridineslactamsmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundspolyhalopyridinespyridinonesvinylogous acidsvinylogous amides |
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| Substituents | beta-hydroxy ketonecarbonyl grouplactamcarboxylic acidaryl alkyl ketonepolyhalopyridine1-hydroxy-2-unsubstituted benzenoidcarboxylic acid derivativebeta-keto acidketoneorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amideazacycleheteroaromatic compoundhydroxypyridinedihydroquinolinedihydroxyquinolinehydroxyquinolinevinylogous acidmonocarboxylic acid or derivativesdihydroquinolonepyridineorganic oxygen compoundketo acidhydrocarbon derivativebenzenoidorganic nitrogen compoundpyridinoneorganooxygen compoundaryl ketone |
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