| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 14:43:57 UTC |
|---|
| Update Date | 2025-03-25 00:47:52 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02164595 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C15H20O3 |
|---|
| Molecular Mass | 248.1412 |
|---|
| SMILES | CC(c1ccc2c(c1)OCO2)C1(O)CCCCC1 |
|---|
| InChI Key | QGQDJZIZNVMYOV-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | benzodioxoles |
|---|
| Subclass | benzodioxoles |
|---|
| Direct Parent | benzodioxoles |
|---|
| Geometric Descriptor | aromatic heteropolycyclic compounds |
|---|
| Alternative Parents | acetalsbenzenoidscyclic alcohols and derivativescyclohexanolshydrocarbon derivativesoxacyclic compoundstertiary alcohols |
|---|
| Substituents | alcoholcyclohexanolcyclic alcoholoxacycletertiary alcoholorganic oxygen compoundacetalaromatic heteropolycyclic compoundhydrocarbon derivativebenzenoidorganooxygen compoundbenzodioxole |
|---|
