Compound Summary
Compound Information
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
Compound Name: | Butanedioic acid, 2-hydroxy-, 1-ethyl ester |
Compound CID: | 21580376 |
Synonyms: | Butanedioic acid, 2-hydroxy-, 1-ethyl ester 4-ethoxy-3-hydroxy-4-oxobutanoic acid 71901-42-3 malic acid ethyl ester SCHEMBL305091 More... |
Iupac Name: | 4-ethoxy-3-hydroxy-4-oxobutanoic acid |
InChI: | InChI=1S/C6H10O5/c1-2-11-6(10)4(7)3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9) |
InChIKey: | FHHFKGGCXNOIAY-UHFFFAOYSA-N |
Canonical Smiles: | CCOC(=O)C(CC(=O)O)O |
Isomeric Smiles: | CCOC(=O)C(CC(=O)O)O |
Molecular Weight: | 162.14 |
Molecular Formula: | C6H10O5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
Molecular Weight: | 162.14 |
Molecular Formula: | C6H10O5 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 11 |
Complexity: | 153 |
Synonyms
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
| Butanedioic acid, 2-hydroxy-, 1-ethyl ester | Butanedioic acid, 2-hydroxy-, 1-ethyl ester |
|---|---|
Butanedioic acid, 2-hydroxy-, 1-ethyl ester |
4-ethoxy-3-hydroxy-4-oxobutanoic acid |
71901-42-3 |
malic acid ethyl ester |
SCHEMBL305091 |
2-Hydroxybutanedioic acid 1-ethyl ester |
Experimental Data
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
| 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 | 100 | umol/L | 0 | NS | N2 | 32334190 | Inactive |
Experimental Data Visualization
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
Statistics Data
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0 | 1 | 1 |
Statistics Data Visualization
Butanedioic acid, 2-hydroxy-, 1-ethyl ester
