| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:58:06 UTC |
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| Update Date | 2025-03-25 00:52:55 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02196820 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C29H45NO3+ |
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| Molecular Mass | 455.3394 |
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| SMILES | CCC=CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OCC[N+](C)CO |
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| InChI Key | YDLKPDJTZVJYTC-UHFFFAOYSA-N |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | lipids and lipid-like molecules |
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| Class | fatty acyls |
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| Subclass | fatty acid esters |
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| Direct Parent | fatty acid esters |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | carbonyl compoundscarboxylic acid estershemiaminalshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativehemiaminalfatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganooxygen compoundalkanolamine |
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