| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-21 14:38:31 UTC |
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| Update Date | 2025-03-25 00:45:57 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID02152346 |
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| Frequency | 0.5 |
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| Structure | |
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| Chemical Formula | C12H25NO5P+ |
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| Molecular Mass | 294.1465 |
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| SMILES | C=CCCCCC(=O)OP(=O)(O)OCC[N+](C)(C)C |
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| InChI Key | BJMSZFJYDQEUSS-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 | acyl phosphatesaminescarbonyl compoundshydrocarbon derivativesmonoalkyl phosphatesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
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| Substituents | aliphatic acyclic compoundcarbonyl grouptetraalkylammonium saltcarboxylic acid derivativephosphocholineorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid estermonoalkyl phosphateorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compoundacyl phosphate |
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