| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 05:26:49 UTC |
|---|
| Update Date | 2025-03-24 14:19:45 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00835164 |
|---|
| Frequency | 1.8 |
|---|
| Structure | |
|---|
| Chemical Formula | C4H6O2 |
|---|
| Molecular Mass | 86.0368 |
|---|
| SMILES | O=CC1(O)CC1 |
|---|
| InChI Key | PEDSSYSZXFKUEG-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | alcohols and polyols |
|---|
| Direct Parent | tertiary alcohols |
|---|
| Geometric Descriptor | aliphatic homomonocyclic compounds |
|---|
| Alternative Parents | aldehydescyclic alcohols and derivativeshydrocarbon derivativesorganic oxides |
|---|
| Substituents | carbonyl grouptertiary alcoholorganic oxidealiphatic homomonocyclic compoundaldehydehydrocarbon derivativecyclopropanol |
|---|
