| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:39:44 UTC |
|---|
| Update Date | 2025-03-25 00:46:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02155225 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C19H22O |
|---|
| Molecular Mass | 266.1671 |
|---|
| SMILES | Cc1cc2c(cc1C)C(C)(c1ccccc1)OC2(C)C |
|---|
| InChI Key | TUCBGGMGVNOHCF-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | isocoumarans |
|---|
| Subclass | isocoumarans |
|---|
| Direct Parent | isocoumarans |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | benzene and substituted derivativesdialkyl ethershydrocarbon derivativesoxacyclic compounds |
|---|
| Substituents | oxacyclemonocyclic benzene moietyetherisocoumaranorganic oxygen compoundaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoiddialkyl etherorganooxygen compound |
|---|
