| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 15:30:45 UTC |
|---|
| Update Date | 2025-03-25 01:05:02 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID02271691 |
|---|
| Frequency | 0.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H8O4 |
|---|
| Molecular Mass | 132.0423 |
|---|
| SMILES | OC1COC2(O)COC12 |
|---|
| InChI Key | KVFNFAIEZGDXQU-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organoheterocyclic compounds |
|---|
| Class | dioxepanes |
|---|
| Subclass | 1,4-dioxepanes |
|---|
| Direct Parent | 1,4-dioxepanes |
|---|
| Geometric Descriptor | aliphatic heteropolycyclic compounds |
|---|
| Alternative Parents | dialkyl ethershemiacetalshydrocarbon derivativesmonosaccharidesoxacyclic compoundsoxetanessecondary alcoholstetrahydrofurans |
|---|
| Substituents | alcoholethertetrahydrofuran1,4-dioxepanemonosaccharidedialkyl etheraliphatic heteropolycyclic compoundoxacyclesaccharideorganic oxygen compoundoxetanesecondary alcoholhemiacetalhydrocarbon derivativeorganooxygen compound |
|---|
