| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 08:31:29 UTC |
|---|
| Update Date | 2025-03-25 00:19:21 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01279544 |
|---|
| Frequency | 1.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H11NO2 |
|---|
| Molecular Mass | 141.079 |
|---|
| SMILES | COC(=O)C1=C(C)NCC1 |
|---|
| InChI Key | BZBZCULXKZYVAV-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolines |
|---|
| Subclass | pyrrolines |
|---|
| Direct Parent | pyrrolines |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | amino acids and derivativesazacyclic compoundscarbonyl compoundsdialkylaminesenoate estershydrocarbon derivativesmethyl estersmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundsvinylogous amides |
|---|
| Substituents | enoate estervinylogous amidesecondary aliphatic aminecarbonyl groupazacycleamino acid or derivativessecondary aminecarboxylic acid derivativealpha,beta-unsaturated carboxylic esterorganic oxidemonocarboxylic acid or derivativesmethyl esterorganic oxygen compoundpyrrolinecarboxylic acid esteraliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
|---|
