Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 14:46:27 UTC |
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Update Date | 2025-03-25 00:48:49 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID02170321 |
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Frequency | 0.5 |
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Structure | |
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Chemical Formula | C33H68NO3+ |
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Molecular Mass | 526.5194 |
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SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCOCC[N+](C)(C)C |
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InChI Key | CRKHNJKAKWFDSY-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 | aminescarbonyl compoundscarboxylic acid estersdialkyl ethershydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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Substituents | aliphatic acyclic compoundcarbonyl groupethertetraalkylammonium saltquaternary ammonium saltcarboxylic acid derivativedialkyl etherfatty acid esterorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundcarboxylic acid esterorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganic cationorganic saltamineorganooxygen compound |
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