| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 15:12:16 UTC |
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| Update Date | 2025-03-25 00:58:13 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02229377 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C22H45NO7P+ |
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| Molecular Mass | 466.2928 |
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| SMILES | CCCCCCCCCCCCCC(=O)OC(C=O)COP(=O)(O)OCC[N+](C)(C)C |
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| InChI Key | DNWGUWLFLNOCSD-UHFFFAOYSA-O |
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| Chemical Taxonomy |
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| Kingdom | organic compounds |
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| Superclass | organic nitrogen compounds |
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| Class | organonitrogen compounds |
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| Subclass | quaternary ammonium salts |
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| Direct Parent | phosphocholines |
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| Geometric Descriptor | aliphatic acyclic compounds |
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| Alternative Parents | aldehydesalpha-acyloxy aldehydesaminescarboxylic acid estersdialkyl phosphatesfatty acid estershydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | fatty acylaliphatic acyclic compoundcarbonyl groupcarboxylic acid derivativeorganic oxideorganopnictogen compoundorganic cationorganic saltalpha-acyloxy aldehydetetraalkylammonium saltaldehydephosphocholinefatty acid esterdialkyl phosphatemonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estercarboxylic acid esterhydrocarbon derivativeorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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