| Record Information |
|---|
| HMDB Status | quantified |
|---|
| Creation Date | 2024-02-20 23:33:45 UTC |
|---|
| Update Date | 2025-03-21 17:56:16 UTC |
|---|
| HMDB ID | HMDB0000720 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00000858 |
|---|
| Name | Levulinic acid |
|---|
| Frequency | 6587.0 |
|---|
| Structure | |
|---|
| Chemical Formula | C5H8O3 |
|---|
| Molecular Mass | 116.0473 |
|---|
| SMILES | CC(=O)CCC(=O)O |
|---|
| InChI Key | JOOXCMJARBKPKM-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | keto acids and derivatives |
|---|
| Subclass | gamma-keto acids and derivatives |
|---|
| Direct Parent | gamma-keto acids and derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | carboxylic acidshydrocarbon derivativesketonesmonocarboxylic acids and derivativesorganic oxidesshort-chain keto acids and derivatives |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidshort-chain keto acidcarboxylic acid derivativegamma-keto acidketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundhydrocarbon derivativeorganooxygen compound |
|---|