| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 01:29:06 UTC |
|---|
| Update Date | 2025-03-21 19:18:54 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00271633 |
|---|
| Frequency | 7.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H7NO2 |
|---|
| Molecular Mass | 101.0477 |
|---|
| SMILES | NCC(=O)CC=O |
|---|
| InChI Key | HTOYHEAONULFTP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | beta ketoaldehydes |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha-hydrogen aldehydeshydrocarbon derivativesketonesmonoalkylaminesorganic oxidesorganonitrogen compoundsorganopnictogen compounds |
|---|
| Substituents | aliphatic acyclic compoundbeta-ketoaldehydeketoneorganic oxidealpha-hydrogen aldehydeorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound |
|---|
