Compound Summary
Compound Information
3-methyl-2-oxobutanoate
Compound Name: | 3-methyl-2-oxobutanoate |
Compound CID: | 5204641 |
Synonyms: | 3-methyl-2-oxobutanoate alpha-keto-isovalerate 2-oxoisopentanoate 3-Methyl-2-oxobutyrate alpha-keto-valine More... |
Iupac Name: | 3-methyl-2-oxobutanoate |
InChI: | InChI=1S/C5H8O3/c1-3(2)4(6)5(7)8/h3H,1-2H3,(H,7,8)/p-1 |
InChIKey: | QHKABHOOEWYVLI-UHFFFAOYSA-M |
Canonical Smiles: | CC(C)C(=O)C(=O)[O-] |
Isomeric Smiles: | CC(C)C(=O)C(=O)[O-] |
Molecular Weight: | 115.11 |
Molecular Formula: | C5H7O3- |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
3-methyl-2-oxobutanoate
Molecular Weight: | 115.11 |
Molecular Formula: | C5H7O3- |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 3 |
Rotatable Bond Count: | 1 |
Heavy Atom Count: | 8 |
Complexity: | 109 |
Synonyms
3-methyl-2-oxobutanoate
| 3-methyl-2-oxobutanoate | 3-methyl-2-oxobutanoate |
|---|---|
3-methyl-2-oxobutanoate |
alpha-keto-isovalerate |
2-oxoisopentanoate |
3-Methyl-2-oxobutyrate |
alpha-keto-valine |
2-keto-isovalerate |
3u6w |
alpha-ketoisopentanoic acid |
CHEBI:11851 |
Q28487657 |
Experimental Data
3-methyl-2-oxobutanoate
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 10 | mM | 21.7 | 29.3 | 0.35 | S | N2 | 26729005 | Active |
Experimental Data Visualization
3-methyl-2-oxobutanoate
Statistics Data
3-methyl-2-oxobutanoate
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0.35 | 1 | 1 |
Statistics Data Visualization
3-methyl-2-oxobutanoate
