| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:52:48 UTC |
|---|
| Update Date | 2025-03-21 18:03:36 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00045278 |
|---|
| Frequency | 74.4 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H18NO+ |
|---|
| Molecular Mass | 132.1383 |
|---|
| SMILES | CC(O)CC[N+](C)(C)C |
|---|
| InChI Key | JWLVVWBHILZADA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic nitrogen compounds |
|---|
| Class | organonitrogen compounds |
|---|
| Subclass | amines |
|---|
| Direct Parent | 1,3-aminoalcohols |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | amineshydrocarbon derivativesorganic cationsorganic saltsorganopnictogen compoundssecondary alcoholstetraalkylammonium salts |
|---|
| Substituents | alcoholaliphatic acyclic compound1,3-aminoalcoholtetraalkylammonium saltquaternary ammonium saltorganic oxygen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic cationorganic saltorganooxygen compound |
|---|
