Compound Summary
S-(-)-Eticlopride hydrochloride
Compound Information
S-(-)-Eticlopride hydrochloride
Compound Name: | S-(-)-Eticlopride hydrochloride |
Compound CID: | 11973707 |
Synonyms: | S-(-)-Eticlopride hydrochloride E-101 EU-0100484 CHEMBL1570350 Tox21_500484 More... |
Iupac Name: | 5-chloro-3-ethyl-N-[[(3S)-1-ethylpyrrolidin-3-yl]methyl]-2-hydroxy-6-methoxybenzamide;hydrochloride |
InChI: | InChI=1S/C17H25ClN2O3.ClH/c1-4-12-8-13(18)16(23-3)14(15(12)21)17(22)19-9-11-6-7-20(5-2)10-11;/h8,11,21H,4-7,9-10H2,1-3H3,(H,19,22);1H/t11-;/m0./s1 |
InChIKey: | RDZXYWICCLALQM-MERQFXBCSA-N |
Canonical Smiles: | CCC1=CC(=C(C(=C1O)C(=O)NCC2CCN(C2)CC)OC)Cl.Cl |
Isomeric Smiles: | CCC1=CC(=C(C(=C1O)C(=O)NC[C@@H]2CCN(C2)CC)OC)Cl.Cl |
Molecular Weight: | 377.3 |
Molecular Formula: | C17H26Cl2N2O3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
S-(-)-Eticlopride hydrochloride
Molecular Weight: | 377.3 |
Molecular Formula: | C17H26Cl2N2O3 |
Hydrogen Bond Donor Count: | 3 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 6 |
Heavy Atom Count: | 24 |
Complexity: | 396 |
Synonyms
S-(-)-Eticlopride hydrochloride
| S-(-)-Eticlopride hydrochloride | S-(-)-Eticlopride hydrochloride |
|---|---|
S-(-)-Eticlopride hydrochloride |
E-101 |
EU-0100484 |
CHEMBL1570350 |
Tox21_500484 |
CCG-221788 |
LP00484 |
NCGC00261169-01 |
SR-01000075870 |
SR-01000075870-1 |
Experimental Data
S-(-)-Eticlopride hydrochloride
| 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 | 33.000000000000000 | umol/L | 14.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
S-(-)-Eticlopride hydrochloride
Statistics Data
S-(-)-Eticlopride hydrochloride
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 14.000000000000000 | 1 | 1 |
Statistics Data Visualization
S-(-)-Eticlopride hydrochloride
