| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:20:20 UTC |
|---|
| Update Date | 2025-03-21 18:36:33 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00111175 |
|---|
| Frequency | 23.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H12NO2+ |
|---|
| Molecular Mass | 130.0863 |
|---|
| SMILES | C[N+](C)(C)CC(O)=C=O |
|---|
| InChI Key | KTSJNINORUFTAS-UHFFFAOYSA-O |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic nitrogen compounds |
|---|
| Class | organonitrogen compounds |
|---|
| Subclass | quaternary ammonium salts |
|---|
| Direct Parent | tetraalkylammonium salts |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alkanolamineshydrocarbon derivativesorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsynolates |
|---|
| Substituents | aliphatic acyclic compoundtetraalkylammonium saltorganic oxideorganic oxygen compoundynolateorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltamineorganooxygen compoundalkanolamine |
|---|
