| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:39:11 UTC |
|---|
| Update Date | 2025-03-25 00:46:12 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02153956 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C16H18O6 |
|---|
| Molecular Mass | 306.1103 |
|---|
| SMILES | COc1ccc2c3c1OC1C(O)C=CC(O)C(O)C1C3CO2 |
|---|
| InChI Key | TUXCOBFLLYZXCP-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzopyrans |
|---|
| Subclass | 1-benzopyrans |
|---|
| Direct Parent | 1-benzopyrans |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | alkyl aryl ethersanisolescoumaranshydrocarbon derivativesoxacyclic compoundssecondary alcohols |
|---|
| Substituents | alcoholphenol etherether1-benzopyranalkyl aryl etheroxacycleorganic oxygen compoundaromatic heteropolycyclic compoundanisolesecondary alcoholhydrocarbon derivativebenzenoidcoumaranorganooxygen compound |
|---|
