Compound Summary
Ehretiquinone
Compound Information
Ehretiquinone
Compound Name: | Ehretiquinone |
Compound CID: | 60201866 |
Synonyms: | Ehretiquinone CHEMBL2204396 More... |
Iupac Name: | (1R,9R,10S)-6-hydroxy-16-methyl-10-[(1E)-3-methylbuta-1,3-dienyl]-2-oxatetracyclo[7.5.3.01,10.03,8]heptadeca-3(8),4,6,12,16-pentaene-11,14-dione |
InChI: | InChI=1S/C22H20O4/c1-13(2)8-9-21-17-10-14(3)12-22(21,20(25)7-6-19(21)24)26-18-5-4-15(23)11-16(17)18/h4-11,17,23H,1,12H2,2-3H3/b9-8+/t17-,21-,22+/m1/s1 |
InChIKey: | OPQSUOOZICECMR-XXGLGJQRSA-N |
Canonical Smiles: | CC1=CC2C3=C(C=CC(=C3)O)OC4(C1)C2(C(=O)C=CC4=O)C=CC(=C)C |
Isomeric Smiles: | CC1=C[C@@H]2C3=C(C=CC(=C3)O)O[C@]4(C1)[C@]2(C(=O)C=CC4=O)/C=C/C(=C)C |
Molecular Weight: | 348.4 |
Molecular Formula: | C22H20O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Ehretiquinone
Molecular Weight: | 348.4 |
Molecular Formula: | C22H20O4 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 26 |
Complexity: | 773 |
Synonyms
Ehretiquinone
| Ehretiquinone | Ehretiquinone |
|---|---|
Ehretiquinone |
CHEMBL2204396 |
Experimental Data
Ehretiquinone
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Saccharomyces cerevisiae | 3.000000000000000 | umol/L | 7.420000000000000 | 10.330000000000000 | 0.390000000000000 | S | K6001 | 33510837 | Active | ||||
| Saccharomyces cerevisiae | 10.000000000000000 | umol/L | 7.420000000000000 | 10.580000000000000 | 0.430000000000000 | S | K6001 | 33510837 | Active | ||||
| Saccharomyces cerevisiae | 0.100000000000000 | umol/L | 7.420000000000000 | 7.300000000000000 | -0.020000000000000 | NS | K6001 | 33510837 | Inactive | ||||
| Saccharomyces cerevisiae | 30.000000000000000 | umol/L | 7.420000000000000 | 7.780000000000000 | 0.050000000000000 | NS | K6001 | 33510837 | Inactive | ||||
| Saccharomyces cerevisiae | 1.000000000000000 | umol/L | 7.420000000000000 | 9.630000000000000 | 0.300000000000000 | S | K6001 | 33510837 | Active |
Experimental Data Visualization
Ehretiquinone
Statistics Data
Ehretiquinone
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Saccharomyces cerevisiae | 0.430000000000000 | 1 | 5 |
Statistics Data Visualization
Ehretiquinone
