| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 08:47:10 UTC |
|---|
| Update Date | 2025-03-25 00:25:06 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01316312 |
|---|
| Frequency | 1.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C7H12O3 |
|---|
| Molecular Mass | 144.0786 |
|---|
| SMILES | OC1CC(O)C2CC1CO2 |
|---|
| InChI Key | PAARBFYXHVBCCN-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | oxepanes |
|---|
| Subclass | oxepanes |
|---|
| Direct Parent | oxepanes |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | cyclic alcohols and derivativesdialkyl ethershydrocarbon derivativesoxacyclic compoundssecondary alcoholstetrahydrofurans |
|---|
| Substituents | alcoholethertetrahydrofurancyclic alcoholdialkyl etheraliphatic heteropolycyclic compoundoxepaneoxacycleorganic oxygen compoundsecondary alcoholhydrocarbon derivativeorganooxygen compound |
|---|
