| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:12:07 UTC |
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| Update Date | 2025-03-21 18:32:28 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00091046 |
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| Frequency | 30.9 |
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| Structure | |
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| Chemical Formula | C11H13NO8 |
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| Molecular Mass | 287.0641 |
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| SMILES | O=C(O)c1c(O)c(=O)ccn1C1OC(CO)C(O)C1O |
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| InChI Key | DBVJUEJSYAYLHD-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-halopyridinesazacyclic compoundscarboxylic acidscyclic ketonesheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmonocarboxylic acids and derivativesmonosaccharidesorganic oxidesorganonitrogen compoundsorganopnictogen compoundsoxacyclic compoundspolyhalopyridinesprimary alcoholssecondary alcoholstetrahydrofuransvinylogous acidsvinylogous amides |
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| Substituents | carboxylic acidaromatic heteromonocyclic compoundpolyhalopyridinemonosaccharidecyclic ketonecarboxylic acid derivativesaccharideorganic oxidepyridine-2-carboxylic acidorganonitrogen compoundorganopnictogen compound2-halopyridineprimary alcoholalcoholvinylogous amideazacycletetrahydrofuranheteroaromatic compoundhydroxypyridineoxacyclevinylogous acidmonocarboxylic acid or derivativesorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundorganooxygen compound |
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