| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 09:13:24 UTC |
|---|
| Update Date | 2025-03-24 20:13:42 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01379590 |
|---|
| Frequency | 0.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H8N2O2 |
|---|
| Molecular Mass | 140.0586 |
|---|
| SMILES | O=C(O)C1N=CC2CNC21 |
|---|
| InChI Key | MONHKNRTBAJCRF-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | carboxylic acids and derivatives |
|---|
| Subclass | amino acids, peptides, and analogues |
|---|
| Direct Parent | alpha amino acids |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,4-diazepinesamino acidsazacyclic compoundsazetidinescarbonyl compoundscarboxylic acidsdialkylamineshydrocarbon derivativesiminesmonocarboxylic acids and derivativesorganic oxidesorganopnictogen compoundspropargyl-type 1,3-dipolar organic compoundspyrroline 2-carboxylic acids |
|---|
| Substituents | carbonyl groupcarboxylic acidamino acidiminepropargyl-type 1,3-dipolar organic compoundaliphatic heteropolycyclic compoundorganic oxideorganonitrogen compoundalpha-amino acidorganopnictogen compoundorganoheterocyclic compoundsecondary aliphatic amineazacyclepyrroline carboxylic acid or derivativesorganic 1,3-dipolar compoundsecondary aminepyrroline 2-carboxylic acidazetidinemonocarboxylic acid or derivativespara-diazepinepyrrolineorganic oxygen compoundpyrroline carboxylic acidhydrocarbon derivativeorganic nitrogen compoundorganooxygen compoundamine |
|---|
