| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 02:31:07 UTC |
|---|
| Update Date | 2025-03-21 20:57:53 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00416828 |
|---|
| Frequency | 4.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H9NO3 |
|---|
| Molecular Mass | 143.0582 |
|---|
| SMILES | O=C(O)C1=CNCC(O)C1 |
|---|
| InChI Key | XJEULGFCZWNQME-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyridines and derivatives |
|---|
| Subclass | hydropyridines |
|---|
| Direct Parent | tetrahydropyridines |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | amino acidsazacyclic compoundscarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundssecondary alcoholsvinylogous amides |
|---|
| Substituents | alcoholvinylogous amidesecondary aliphatic aminecarbonyl groupcarboxylic acidazacycleamino acid or derivativesamino acidtetrahydropyridinesecondary aminecarboxylic acid derivativeorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundsecondary alcoholorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
|---|
