| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:01:35 UTC |
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| Update Date | 2025-03-21 18:06:54 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00065919 |
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| Frequency | 46.4 |
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| Structure | |
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| Chemical Formula | C12H7NO5 |
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| Molecular Mass | 245.0324 |
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| SMILES | O=C(O)c1cc(=O)c2c([nH]1)oc1cc(O)ccc12 |
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| InChI Key | IUMSRSLYGVRWHW-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 | benzofurans |
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| Subclass | benzofurans |
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| Direct Parent | benzofurans |
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| Geometric Descriptor | aromatic heteropolycyclic compounds |
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| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoids2-halopyridinesazacyclic compoundsbenzenoidscarboxylic acidsfuransfuropyridinesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinespyridine-2-carboxylic acidsvinylogous amides |
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| Substituents | pyridine carboxylic acid or derivativesfurancarboxylic acidpolyhalopyridine1-hydroxy-2-unsubstituted benzenoidfuropyridinecarboxylic acid derivativeorganic oxidepyridine-2-carboxylic acidaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compound2-halopyridinevinylogous amidebenzofuranazacycleheteroaromatic compoundhydroxypyridineoxacyclemonocarboxylic acid or derivativespyridineorganic oxygen compoundpyridine carboxylic acidhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compound |
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