| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-21 01:18:33 UTC |
|---|
| Update Date | 2025-03-21 19:10:34 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00247362 |
|---|
| Frequency | 8.5 |
|---|
| Structure | |
|---|
| Chemical Formula | C6H8O2 |
|---|
| Molecular Mass | 112.0524 |
|---|
| SMILES | CCC(C=O)=CC=O |
|---|
| InChI Key | QUMFAIHIBKQSII-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | hydrocarbon derivatives |
|---|
| Class | Not Available |
|---|
| Subclass | hydrocarbon derivatives |
|---|
| Direct Parent | hydrocarbon derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | aldehydesorganic oxides |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl grouporganic oxideorganic oxygen compoundaldehydehydrocarbon derivativeorganooxygen compound |
|---|
