| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:14:29 UTC |
|---|
| Update Date | 2025-03-25 00:59:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02234415 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12NO4+ |
|---|
| Molecular Mass | 174.0761 |
|---|
| SMILES | C[N+]1(C)CC(=O)OC(C(=O)O)C1 |
|---|
| InChI Key | SWACKFSDXKLEIX-UHFFFAOYSA-O |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | carboxylic acids and derivatives |
|---|
| Subclass | amino acids, peptides, and analogues |
|---|
| Direct Parent | alpha amino acid esters |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | alpha amino acidsaminesazacyclic compoundscarbonyl compoundscarboxylic acid esterscarboxylic acidsdicarboxylic acids and derivativeshydrocarbon derivativeslactonesmorpholine carboxylic acidsorganic cationsorganic oxidesorganic saltsorganopnictogen compoundsoxacyclic compoundstetraalkylammonium salts |
|---|
| Substituents | carbonyl groupcarboxylic acidlactoneorganic oxidealiphatic heteromonocyclic compoundorganonitrogen compoundmorpholine-2-carboxylic acid or derivativesalpha-amino acidorganopnictogen compoundorganic cationorganic saltorganoheterocyclic compoundmorpholine-2-carboxylic acidtetraalkylammonium saltalpha-amino acid esterazacyclequaternary ammonium saltoxazinaneoxacyclemorpholineorganic oxygen compoundcarboxylic acid esterdicarboxylic acid or derivativeshydrocarbon derivativeorganic nitrogen compoundamineorganooxygen compound |
|---|
