| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:00:32 UTC |
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| Update Date | 2025-03-25 00:53:51 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02202449 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C11H15ClNO+ |
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| Molecular Mass | 212.0837 |
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| SMILES | C[N+](C)(C)C(C(=O)Cl)c1ccccc1 |
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| InChI Key | FWXFXIMIRGQYHG-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic acids and derivatives |
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| Class | carboxylic acids and derivatives |
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| Subclass | amino acids, peptides, and analogues |
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| Direct Parent | alpha amino acids |
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| Geometric Descriptor | aromatic homomonocyclic compounds |
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| Alternative Parents | acyl chloridesaralkylaminesbenzene and substituted derivativescarbonyl compoundshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganochloridesorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | monocyclic benzene moietycarbonyl grouptetraalkylammonium saltorganochloridequaternary ammonium saltorganohalogen compoundacyl halidearalkylaminearomatic homomonocyclic compoundorganic oxideorganic oxygen compoundacyl chlorideorganonitrogen compoundalpha-amino acidorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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