| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 09:51:43 UTC |
|---|
| Update Date | 2025-03-24 20:30:26 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID01469751 |
|---|
| Frequency | 0.9 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H6O4 |
|---|
| Molecular Mass | 130.0266 |
|---|
| SMILES | COc1c(C)ooc1=O |
|---|
| InChI Key | IYXSTEXBZJRRGT-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | ethers |
|---|
| Direct Parent | alkyl aryl ethers |
|---|
| Geometric Descriptor | aromatic heteromonocyclic compounds |
|---|
| Alternative Parents | heteroaromatic compoundshydrocarbon derivativesorganic oxidesoxacyclic compounds |
|---|
| Substituents | oxacycleorganic oxidearomatic heteromonocyclic compoundheteroaromatic compoundhydrocarbon derivativealkyl aryl etherorganoheterocyclic compound |
|---|
