Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:44:51 UTC |
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Update Date | 2025-03-25 00:48:12 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02166717 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C16H27N2O2+ |
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Molecular Mass | 279.2067 |
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SMILES | CC(=O)Nc1ccc(C(O)CCCC[N+](C)(C)C)cc1 |
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InChI Key | GEBUARZDSZEAAS-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 | anilides |
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Direct Parent | acetanilides |
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Geometric Descriptor | aromatic homomonocyclic compounds |
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Alternative Parents | acetamidesaminesaromatic alcoholscarbonyl compoundscarboxylic acids and derivativeshydrocarbon derivativesn-acetylarylaminesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholssecondary carboxylic acid amidestetraalkylammonium salts |
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Substituents | aromatic alcoholcarbonyl groupn-acetylarylaminen-arylamidecarboxylic acid derivativeorganic oxideorganonitrogen compoundorganopnictogen compoundorganic cationorganic saltacetamidealcoholtetraalkylammonium saltacetanilidequaternary ammonium saltcarboxamide grouparomatic homomonocyclic compoundsecondary carboxylic acid amideorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
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