| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:08:13 UTC |
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| Update Date | 2025-03-25 00:56:44 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02220397 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H16NO3+ |
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| Molecular Mass | 210.1125 |
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| SMILES | C[N+](C)(C)C(Oc1ccccc1)C(=O)O |
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| InChI Key | XRUHNPALIOYCLK-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | benzenoids |
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| Class | benzene and substituted derivatives |
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| Subclass | phenoxyacetic acid derivatives |
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| Direct Parent | phenoxyacetic acid derivatives |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | alpha amino acidscarbonyl compoundscarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsphenol ethersphenoxy compoundstetraalkylammonium salts |
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| Substituents | phenol etherphenoxyacetatecarbonyl groupcarboxylic acidtetraalkylammonium saltalpha-amino acid or derivativescarboxylic acid derivativearomatic homomonocyclic compoundorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationphenoxy compoundorganic saltorganooxygen compound |
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