| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:27:51 UTC |
|---|
| Update Date | 2025-03-21 18:40:13 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00129092 |
|---|
| Frequency | 19.7 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H21NO6P+ |
|---|
| Molecular Mass | 270.1101 |
|---|
| SMILES | CC(COP(=O)(O)OCC[N+](C)(C)C)C(=O)O |
|---|
| InChI Key | CBNFTKZJYUPICL-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 | aminescarbonyl compoundscarboxylic acidsdialkyl phosphateshydrocarbon derivativesmonocarboxylic acids and derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundstetraalkylammonium salts |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidtetraalkylammonium saltcarboxylic acid derivativephosphocholinedialkyl phosphateorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundphosphoric acid esterorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltorganic phosphoric acid derivativeaminealkyl phosphateorganooxygen compound |
|---|
