| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:32:00 UTC |
|---|
| Update Date | 2025-03-25 01:05:30 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02274529 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C9H7N |
|---|
| Molecular Mass | 129.0578 |
|---|
| SMILES | N#Cc1ccc2c(c1)CC2 |
|---|
| InChI Key | KACQOXSDJZTHPE-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | Not Available |
|---|
| Subclass | benzenoids |
|---|
| Direct Parent | benzenoids |
|---|
| Geometric Descriptor | aromatic homopolycyclic compounds |
|---|
| Alternative Parents | hydrocarbon derivativesnitrilesorganonitrogen compoundsorganopnictogen compounds |
|---|
| Substituents | nitrileorganonitrogen compoundorganopnictogen compoundaromatic homopolycyclic compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundcarbonitrile |
|---|
