| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:46:49 UTC |
|---|
| Update Date | 2025-03-21 18:01:05 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00030900 |
|---|
| Frequency | 119.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H9NO |
|---|
| Molecular Mass | 87.0684 |
|---|
| SMILES | CNCC(C)=O |
|---|
| InChI Key | UNCPWMREXAOVOD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | ketones |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | dialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compounds |
|---|
| Substituents | aliphatic acyclic compoundsecondary aliphatic aminesecondary amineketoneorganic oxideorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundamine |
|---|
