Compound Summary
3-methyl-2-oxobutanoate
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 | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 10.000000000000000 | mM | 21.700000000000000 | 29.300000000000000 | 0.350000000000000 | S | N2 | 26729005 | Active |
Experimental Data Visualization
3-methyl-2-oxobutanoate
Statistics Data
3-methyl-2-oxobutanoate
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0.350000000000000 | 1 | 1 |
Statistics Data Visualization
3-methyl-2-oxobutanoate
