| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:14:25 UTC |
|---|
| Update Date | 2025-03-25 00:58:59 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02234255 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C10H11N3O |
|---|
| Molecular Mass | 189.0902 |
|---|
| SMILES | Cc1cc(NCc2ccco2)ncn1 |
|---|
| InChI Key | NBKNIZKSVNHJNT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic nitrogen compounds |
|---|
| Class | organonitrogen compounds |
|---|
| Subclass | amines |
|---|
| Direct Parent | secondary alkylarylamines |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsfuransheteroaromatic compoundshydrocarbon derivativesimidolactamsorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundspyrimidines and pyrimidine derivatives |
|---|
| Substituents | furanaromatic heteromonocyclic compoundazacycleheteroaromatic compoundsecondary aliphatic/aromatic aminepyrimidineoxacycleorganic oxygen compoundorganopnictogen compoundhydrocarbon derivativeimidolactamorganoheterocyclic compoundorganooxygen compound |
|---|
