| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:52:07 UTC |
|---|
| Update Date | 2025-03-21 18:03:21 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00043642 |
|---|
| Frequency | 77.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C12H13NO |
|---|
| Molecular Mass | 187.0997 |
|---|
| SMILES | NCCc1cc(O)cc2ccccc12 |
|---|
| InChI Key | IKOATYHTGVPKEA-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | benzenoids |
|---|
| Class | naphthalenes |
|---|
| Subclass | naphthols and derivatives |
|---|
| Direct Parent | naphthols and derivatives |
|---|
| Geometric Descriptor | aromatic homopolycyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidshydrocarbon derivativesmonoalkylaminesorganonitrogen compoundsorganooxygen compoundsorganopnictogen compounds |
|---|
| Substituents | 1-hydroxy-2-unsubstituted benzenoidaromatic homopolycyclic compoundorganic oxygen compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativeprimary aliphatic amineorganic nitrogen compound2-naphtholorganooxygen compound |
|---|
