| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:36 UTC |
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| Update Date | 2025-03-25 00:53:07 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02198013 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H19N2O3+ |
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| Molecular Mass | 239.139 |
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| SMILES | Cn1cc(C(=O)OCC[N+](C)(C)C)ccc1=O |
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| InChI Key | WMKUZEQBWNEATE-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-3-carboxylic acids |
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| Geometric Descriptor | aromatic heteromonocyclic compounds |
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| Alternative Parents | aminesazacyclic compoundscarboxylic acid estersheteroaromatic compoundshydrocarbon derivativeslactamsmethylpyridinesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganooxygen compoundsorganopnictogen compoundspyridinonestetraalkylammonium saltsvinylogous amides |
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| Substituents | lactamaromatic heteromonocyclic compoundpyridine-3-carboxylic acidcarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltvinylogous amidetetraalkylammonium saltazacyclequaternary ammonium saltheteroaromatic compoundmethylpyridinemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterhydrocarbon derivativeorganic nitrogen compoundpyridinoneamineorganooxygen compound |
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