| Record Information |
|---|
| HMDB Status | Not Available |
|---|
| Creation Date | 2024-02-20 23:57:18 UTC |
|---|
| Update Date | 2025-03-21 18:05:15 UTC |
|---|
| HMDB ID | Not Available |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00055757 |
|---|
| Frequency | 57.3 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H6O3 |
|---|
| Molecular Mass | 114.0317 |
|---|
| SMILES | CCC(=O)C(=O)C=O |
|---|
| InChI Key | IPHREVVCPNNUEQ-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic oxygen compounds |
|---|
| Class | organooxygen compounds |
|---|
| Subclass | carbonyl compounds |
|---|
| Direct Parent | alpha-diketones |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha ketoaldehydesbeta ketoaldehydeshydrocarbon derivativesorganic oxidesshort-chain aldehydes |
|---|
| Substituents | aliphatic acyclic compoundshort-chain aldehydebeta-ketoaldehydealdehydealpha-diketoneorganic oxidehydrocarbon derivativealpha-ketoaldehyde |
|---|
