| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 11:04:49 UTC |
|---|
| Update Date | 2025-03-24 21:01:15 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01645437 |
|---|
| Frequency | 0.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12O3 |
|---|
| Molecular Mass | 144.0786 |
|---|
| SMILES | CC12CCC(CC(O)O1)O2 |
|---|
| InChI Key | MCVGGTGTTBFGHY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | oxepanes |
|---|
| Subclass | oxepanes |
|---|
| Direct Parent | oxepanes |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | 1,3-dioxaneshemiacetalshydrocarbon derivativesketalsorganooxygen compoundsoxacyclic compoundstetrahydrofurans |
|---|
| Substituents | tetrahydrofuranaliphatic heteropolycyclic compoundoxepaneoxacycleorganic oxygen compoundacetalketalhemiacetalhydrocarbon derivativemeta-dioxaneorganooxygen compound |
|---|
