| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 00:01:27 UTC |
|---|
| Update Date | 2025-03-21 18:06:52 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00065591 |
|---|
| Frequency | 46.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C13H15N3 |
|---|
| Molecular Mass | 213.1266 |
|---|
| SMILES | CN(C)CCc1c[nH]c2ccc(C#N)cc12 |
|---|
| InChI Key | DSNBRTOYUJFTAH-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | indoles and derivatives |
|---|
| Subclass | indoles |
|---|
| Direct Parent | indoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsbenzenoidsheteroaromatic compoundshydrocarbon derivativesnitrilesorganopnictogen compoundspyrrolestrialkylamines |
|---|
| Substituents | nitrileazacycleindoleheteroaromatic compoundtertiary aliphatic aminearomatic heteropolycyclic compoundpyrroleorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundaminecarbonitriletertiary amine |
|---|
