| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 03:00:52 UTC |
|---|
| Update Date | 2025-03-21 22:03:56 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00487180 |
|---|
| Frequency | 3.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H8N2O |
|---|
| Molecular Mass | 112.0637 |
|---|
| SMILES | NC(=O)C1=CCNC1 |
|---|
| InChI Key | AFAZWQJKGPGEBO-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyrrolines |
|---|
| Subclass | pyrroline carboxylic acids and derivatives |
|---|
| Direct Parent | pyrroline carboxylic acids and derivatives |
|---|
| Geometric Descriptor | aliphatic heteromonocyclic compounds |
|---|
| Alternative Parents | amino acids and derivativesazacyclic compoundscarbonyl compoundscarboxylic acids and derivativesdialkylamineshydrocarbon derivativesorganic oxidesorganopnictogen compoundsprimary carboxylic acid amides |
|---|
| Substituents | primary carboxylic acid amidesecondary aliphatic aminecarbonyl groupazacycleamino acid or derivativespyrroline carboxylic acid or derivativessecondary aminecarboxamide groupcarboxylic acid derivativeorganic oxideorganic oxygen compoundaliphatic heteromonocyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
|---|
