| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 02:04:39 UTC |
|---|
| Update Date | 2025-03-21 20:46:47 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00354029 |
|---|
| Frequency | 5.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H9NO2 |
|---|
| Molecular Mass | 139.0633 |
|---|
| SMILES | CC(=O)C1=C(C)NCC1=O |
|---|
| InChI Key | DRBDMJFTTJHYSD-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolines |
|---|
| Subclass | pyrrolines |
|---|
| Direct Parent | pyrrolines |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | azacyclic compoundscyclic ketonesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsvinylogous amides |
|---|
| Substituents | vinylogous amidesecondary aliphatic aminecarbonyl groupazacyclecyclic ketonesecondary amineketoneorganic oxideorganic oxygen compoundpyrrolinealiphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
|---|
