Record Information |
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HMDB Status | Not Available |
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Creation Date | 2024-02-21 00:21:04 UTC |
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Update Date | 2025-03-21 18:36:53 UTC |
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HMDB ID | Not Available |
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Metabolite Identification |
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DeepMet ID | DMID00112909 |
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Frequency | 23.5 |
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Structure | |
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Chemical Formula | C22H47NO5P+ |
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Molecular Mass | 436.3186 |
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SMILES | CCCCCCC=CCCCCCCCC(O)COP(=O)(O)OCC[N+](C)(C)C |
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InChI Key | VNFARIFYCVCLEE-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 | aminesdialkyl phosphateshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
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Substituents | alcoholaliphatic acyclic compoundtetraalkylammonium saltphosphocholinedialkyl phosphateorganic oxideorganic oxygen compoundphosphoric acid estersecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
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