| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:26:45 UTC |
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| Update Date | 2025-03-21 18:39:34 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00126440 |
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| Frequency | 20.2 |
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| Structure | |
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| Chemical Formula | C13H11NO4 |
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| Molecular Mass | 245.0688 |
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| SMILES | CC1COc2cccc3c(=O)c(C(=O)O)cn1c23 |
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| InChI Key | ANIMQFJMACSGNN-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-halopyridinesalkyl aryl ethersazacyclic compoundsbenzenoidsbenzoxazinescarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroquinolineshydroquinoloneshydroxypyridinesmethylpyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinespyridine-3-carboxylic acidsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesethercarboxylic acidpyridine-3-carboxylic acidpolyhalopyridinealkyl aryl ethercarboxylic acid derivativequinoline-3-carboxylic acidorganic oxidearomatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amideazacycleheteroaromatic compoundhydroxypyridinedihydroquinolinebenzoxazinemethylpyridineoxacyclemonocarboxylic acid or derivativesdihydroquinolonepyridineorganic oxygen compoundpyridine carboxylic acidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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