| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 00:06:30 UTC |
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| Update Date | 2025-03-21 18:29:30 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00077801 |
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| Frequency | 37.7 |
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| Structure | |
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| Chemical Formula | C15H28NO5+ |
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| Molecular Mass | 302.1962 |
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| SMILES | C[N+](C)(C)C(CCC(=O)O)OC(=O)CCCCCCC=O |
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| InChI Key | KLHQNRKARYLFKT-UHFFFAOYSA-O |
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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 | alpha-hydrogen aldehydescarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganonitrogen compoundsorganopnictogen compoundsshort-chain hydroxy acids and derivativestetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain hydroxy acidtetraalkylammonium saltaldehydecarboxylic acid derivativefatty acid esterorganic oxideorganic oxygen compoundalpha-hydrogen aldehydecarboxylic acid esterorganonitrogen compounddicarboxylic acid or derivativesorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltorganooxygen compound |
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