O,O-bisacetyldaurisoline

From DrugPedia: A Wikipedia for Drug discovery

{{Drugbox | IUPAC_name =[(1R)-1-[[4-acetyloxy-3-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] acetate | PubChem = 195700 | DrugBank = | ChemSpiderID = | chemical_formula =C₄₁H₄₆N₂O₈ | molecular_weight = 694.81254 | smiles = CC(=O)OC1=C(C=C(C=C1)C[C@@H]2C3=CC(=C(C=C3CCN2C)OC)OC(=O)C)OC4=CC=C(C=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)OC | synonyms = | density = | melting_point = | boiling_point = | solubility = | bioavailability = | protein_bound = | metabolism = | elimination_half-life = }}

[edit] Description

inhibits calcium influx into synaptosomes

[edit] General Properties

*Molecular Weight

694.81254

*Molecular Formula

C₄₁H₄₆N₂O₈

*IUPAC NAME

[(1R)-1-[[4-acetyloxy-3-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl] acetate

*Canonical Smiles

CC(=O)OC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCN2C)OC)OC(=O)C)OC4=CC=C(C=C4)CC5C6=CC(=C(C=C6CCN5C)OC)OC

*Isomeric Smiles

CC(=O)OC1=C(C=C(C=C1)C[C@@H]2C3=CC(=C(C=C3CCN2C)OC)OC(=O)C)OC4=CC=C(C=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)OC

*XLogP

5.2

*Topological Polar Surface Area

96