| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:35:46 UTC |
|---|
| Update Date | 2025-03-21 18:46:29 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00147440 |
|---|
| Frequency | 16.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H10N+ |
|---|
| Molecular Mass | 120.0808 |
|---|
| SMILES | c1cc[n+]2c(c1)CCC2 |
|---|
| InChI Key | HCTHCILAGAAXRV-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | pyridines and derivatives |
|---|
| Subclass | halopyridines |
|---|
| Direct Parent | 2-halopyridines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsheteroaromatic compoundshydrocarbon derivativesorganic cationsorganonitrogen compoundsorganopnictogen compoundspyridines and derivatives |
|---|
| Substituents | azacyclearomatic heteropolycyclic compoundheteroaromatic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivative2-halopyridineorganic nitrogen compoundorganic cation |
|---|
