| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:46:07 UTC |
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| Update Date | 2025-03-21 18:00:46 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00029256 |
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| Frequency | 127.9 |
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| Structure | |
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| Chemical Formula | C11H17N2O2+ |
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| Molecular Mass | 209.1285 |
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| SMILES | Cc1ncc(C[N+](C)(C)C)c(C=O)c1O |
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| InChI Key | WKIWDXWGNCLQIY-UHFFFAOYSA-O |
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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 | pyridinecarboxylic acids and derivatives |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | 2-halopyridinesaralkylaminesaryl-aldehydesazacyclic compoundsheteroaromatic compoundshydrocarbon derivativeshydroxypyridinesmethylpyridinesorganic cationsorganic oxidesorganic saltsorganooxygen compoundsorganopnictogen compoundspolyhalopyridinespyridine carboxaldehydestetraalkylammonium saltsvinylogous acids |
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| Substituents | pyridine carboxylic acid or derivativesaromatic heteromonocyclic compoundpolyhalopyridinearalkylamineorganic oxidearyl-aldehydeorganonitrogen compoundorganopnictogen compound2-halopyridineorganic cationorganic salttetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundhydroxypyridinealdehydemethylpyridine4-pyridine carboxaldehydevinylogous acidorganic oxygen compoundhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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