Compound Summary
Compound Information
Oleuropein aglycone
Compound Name: | Oleuropein aglycone |
Compound CID: | 56842347 |
Synonyms: | Oleuropein aglycone 31773-95-2 methyl (4s,5e,6r)-4-2-2-(3,4-dihydroxyphenyl)ethoxy-2-oxoethyl-5-ethylidene-6-hydroxy-4h-pyran-3-carboxylate Oleuropeinaglycon methyl (2R,3E,4S)-4-{2-2-(3,4-dihydroxyphenyl)ethoxy-2-oxoethyl}-3-ethylidene-2-hydroxy-3,4-dihydro-2H-pyran-5-carboxylate More... |
Iupac Name: | methyl (4S,5E,6R)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-hydroxy-4H-pyran-3-carboxylate |
InChI: | InChI=1S/C19H22O8/c1-3-12-13(14(18(23)25-2)10-27-19(12)24)9-17(22)26-7-6-11-4-5-15(20)16(21)8-11/h3-5,8,10,13,19-21,24H,6-7,9H2,1-2H3/b12-3+/t13-,19+/m0/s1 |
InChIKey: | BIWKXNFEOZXNLX-BBHIFXBUSA-N |
Canonical Smiles: | CC=C1C(C(=COC1O)C(=O)OC)CC(=O)OCCC2=CC(=C(C=C2)O)O |
Isomeric Smiles: | C/C=C/1\[C@@H](C(=CO[C@H]1O)C(=O)OC)CC(=O)OCCC2=CC(=C(C=C2)O)O |
Molecular Weight: | 378.4 |
Molecular Formula: | C19H22O8 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Oleuropein aglycone
Molecular Weight: | 378.4 |
Molecular Formula: | C19H22O8 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 8 |
Rotatable Bond Count: | 8 |
Heavy Atom Count: | 27 |
Complexity: | 597 |
Synonyms
Oleuropein aglycone
| Oleuropein aglycone | Oleuropein aglycone |
|---|---|
Oleuropein aglycone |
31773-95-2 |
methyl (4s,5e,6r)-4-2-2-(3,4-dihydroxyphenyl)ethoxy-2-oxoethyl-5-ethylidene-6-hydroxy-4h-pyran-3-carboxylate |
Oleuropeinaglycon |
methyl (2R,3E,4S)-4-{2-2-(3,4-dihydroxyphenyl)ethoxy-2-oxoethyl}-3-ethylidene-2-hydroxy-3,4-dihydro-2H-pyran-5-carboxylate |
Oleuropeine aglycone |
Oleoeuropein aglycone |
Oleuropein-aglycone |
Oleuropein aglycon derivative |
CHEMBL4471855 |
SCHEMBL12642033 |
CHEBI:139162 |
2H-Pyran-4-acetic acid, 3-ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-, 2-(3,4-dihydroxyphenyl) ethyl ester, (2R-(2alpha,3E,4beta))- |
XO180873 |
Experimental Data
Oleuropein aglycone
| 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 | 30 | ug/mL | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 250 | ug/mL | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 100 | ug/mL | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 500 | ug/mL | 2.7 | NS | N2 | 33683565 | Inactive |
Experimental Data Visualization
Oleuropein aglycone
Statistics Data
Oleuropein aglycone
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 2.7 | 1 | 4 |
Statistics Data Visualization
Oleuropein aglycone
