| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:08:59 UTC |
|---|
| Update Date | 2025-03-25 00:57:01 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02222132 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C10H10O2 |
|---|
| Molecular Mass | 162.0681 |
|---|
| SMILES | Oc1ccc2c(c1)OCCC=C2 |
|---|
| InChI Key | SECPDCQOKCUOAO-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzoxepines |
|---|
| Subclass | benzoxepines |
|---|
| Direct Parent | benzoxepines |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1-hydroxy-2-unsubstituted benzenoidsalkyl aryl ethersbenzenoidshydrocarbon derivativesoxacyclic compounds |
|---|
| Substituents | oxacycleetherorganic oxygen compoundaromatic heteropolycyclic compoundbenzoxepine1-hydroxy-2-unsubstituted benzenoidhydrocarbon derivativebenzenoidalkyl aryl etherorganooxygen compound |
|---|
