| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:46:33 UTC |
|---|
| Update Date | 2025-03-21 18:00:58 UTC |
|---|
| HMDB ID | HMDB0040582 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00030253 |
|---|
| Name | 1-Methyl-2-pyrrolecarboxaldehyde |
|---|
| Frequency | 123.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H7NO |
|---|
| Molecular Mass | 109.0528 |
|---|
| SMILES | Cn1cccc1C=O |
|---|
| InChI Key | OUKQTRFCDKSEPL-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | aryl-aldehydes |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesn-methylpyrrolesorganic oxidesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compoundssubstituted pyrroles |
|---|
| Substituents | n-methylpyrrolearomatic heteromonocyclic compoundazacycleheteroaromatic compoundsubstituted pyrroleorganic oxidearyl-aldehydepyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeorganic nitrogen compoundorganoheterocyclic compound |
|---|
