| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:15:54 UTC |
|---|
| Update Date | 2025-03-21 18:34:19 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00100236 |
|---|
| Frequency | 27.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C21H48N2O5P+ |
|---|
| Molecular Mass | 439.3295 |
|---|
| SMILES | CCCCCCCCCCCCCC(O)C(N)COP(=O)(O)OCC[N+](C)(C)C |
|---|
| InChI Key | YDBVSRBRPMSJKL-UHFFFAOYSA-O |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic nitrogen compounds |
|---|
| Class | organonitrogen compounds |
|---|
| Subclass | quaternary ammonium salts |
|---|
| Direct Parent | phosphocholines |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | aminesdialkyl phosphateshydrocarbon derivativesmonoalkylaminesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsphosphoethanolaminessecondary alcoholstetraalkylammonium salts |
|---|
| Substituents | alcoholaliphatic acyclic compoundtetraalkylammonium saltphosphocholinedialkyl phosphatephosphoethanolamineorganic oxideorganic oxygen compoundphosphoric acid estersecondary alcoholorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic cationorganic saltorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
|---|
