| Record Information |
|---|
| HMDB Status | expected |
|---|
| Creation Date | 2024-02-20 23:34:12 UTC |
|---|
| Update Date | 2025-03-21 17:56:32 UTC |
|---|
| HMDB ID | HMDB0013211 |
|---|
| Metabolite Identification |
|---|
| DeepMet ID | DMID00001923 |
|---|
| Name | Alpha-Ketooctanoic acid |
|---|
| Frequency | 3167.6 |
|---|
| Structure | |
|---|
| Chemical Formula | C8H14O3 |
|---|
| Molecular Mass | 158.0943 |
|---|
| SMILES | CCCCCCC(=O)C(=O)O |
|---|
| InChI Key | GPPUPQFYDYLTIY-UHFFFAOYSA-N |
|---|
| Chemical Taxonomy |
|---|
| Kingdom | organic compounds |
|---|
| Superclass | organic acids and derivatives |
|---|
| Class | keto acids and derivatives |
|---|
| Subclass | medium-chain keto acids and derivatives |
|---|
| Direct Parent | medium-chain keto acids and derivatives |
|---|
| Geometric Descriptor | aliphatic acyclic compounds |
|---|
| Alternative Parents | alpha-hydroxy ketonesalpha-keto acids and derivativescarboxylic acidshydrocarbon derivativesmonocarboxylic acids and derivativesorganic oxides |
|---|
| Substituents | aliphatic acyclic compoundcarbonyl groupcarboxylic acidalpha-hydroxy ketonecarboxylic acid derivativeketoneorganic oxidemonocarboxylic acid or derivativesorganic oxygen compoundalpha-keto acidhydrocarbon derivativeorganooxygen compoundmedium-chain keto acid |
|---|
