| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:42:21 UTC |
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| Update Date | 2025-03-21 17:59:23 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00020552 |
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| Frequency | 196.7 |
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| Structure | |
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| Chemical Formula | C7H5NO3 |
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| Molecular Mass | 151.0269 |
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| SMILES | O=Cc1cccc(C(=O)O)n1 |
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| InChI Key | DAUQNAWDINBWER-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 | pyridines and derivatives |
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| Subclass | pyridinecarboxylic acids and derivatives |
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| Direct Parent | pyridine-2-carboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaryl-aldehydesazacyclic compoundscarboxylic acidsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridine carboxaldehydes |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundpolyhalopyridinecarboxylic acid derivativeorganic oxidepyridine-2-carboxylic acidaryl-aldehydeorganonitrogen compoundorganopnictogen compound2-halopyridineazacycleheteroaromatic compoundhydroxypyridinealdehydemonocarboxylic acid or derivatives2-pyridine carboxaldehydeorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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