| Record Information |
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| HMDB Status | Not Available |
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| Creation Date | 2024-02-20 23:54:13 UTC |
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| Update Date | 2025-03-21 18:04:08 UTC |
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| HMDB ID | Not Available |
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| Metabolite Identification |
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| DeepMet ID | DMID00048647 |
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| Frequency | 68.1 |
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| Structure | |
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| Chemical Formula | C8H22NO9P2+ |
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| Molecular Mass | 338.0764 |
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| SMILES | C[N+](C)(C)CCOP(=O)(O)OP(=O)(O)OCC(O)CO |
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| InChI Key | RUURZRHVWOVGLU-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 | 1,2-diolsamineshydrocarbon derivativesmonoalkyl phosphatesorganic cationsorganic oxidesorganic pyrophosphatesorganic saltsorganopnictogen compoundsprimary alcoholssecondary alcoholstetraalkylammonium salts |
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| Substituents | alcoholaliphatic acyclic compoundtetraalkylammonium saltorganic pyrophosphatephosphocholineorganic oxideorganic oxygen compoundphosphoric acid estermonoalkyl phosphatesecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltprimary alcoholorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound1,2-diol |
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