| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:57:39 UTC |
|---|
| Update Date | 2025-03-25 00:52:45 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02195839 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C14H13NO |
|---|
| Molecular Mass | 211.0997 |
|---|
| SMILES | CC1(c2ccccc2)Nc2ccccc2O1 |
|---|
| InChI Key | DWGLVJPBERSKJI-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzoxazolines |
|---|
| Subclass | benzoxazolines |
|---|
| Direct Parent | benzoxazolines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | azacyclic compoundsbenzene and substituted derivativeshydrocarbon derivativesorganooxygen compoundsorganopnictogen compoundsoxacyclic compoundssecondary alkylarylamines |
|---|
| Substituents | monocyclic benzene moietyazacyclebenzoxazolinesecondary aminesecondary aliphatic/aromatic amineoxacycleorganic oxygen compoundaromatic heteropolycyclic compoundorganonitrogen compoundorganopnictogen compoundhydrocarbon derivativebenzenoidorganic nitrogen compoundorganooxygen compoundamine |
|---|
