BIAdb Daurisoline 1995

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{{Drugbox | IUPAC_name =(1R)-1-[[3-[4-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenoxy]-4-hydroxyphenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol | PubChem = 51106 | DrugBank = | ChemSpiderID = | chemical_formula =C₃₇H₄₂N₂O₆ | molecular_weight = 610.73918 | smiles = CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC)OC | synonyms = | density = | melting_point = | boiling_point = | solubility = | bioavailability = | protein_bound = | metabolism = | elimination_half-life = }}

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

[edit] Description

[edit] Source

Menispermun dahuricum

[edit] Function

Antiarrhythmic

[edit] General Properties

*Molecular Weight

610.73918

*Exact Mass

610.304287

*Molecular Formula

C₃₇H₄₂N₂O₆

*IUPAC NAME

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

*Canonical Smiles

CN1CCC2=CC(=C(C=C2C1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)CC5C6=CC(=C(C=C6CCN5C)OC)O)O)OC)OC

*Isomeric Smiles

CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)O)O)OC)OC

*XLogP

6.4

*Hydrogen bond donor

2

*Hydrogen bond acceptor

8

*Rotational Bond Count

9

*Topological Polar Surface Area

83.9

[edit] External Links

• Pubchem

Link to BIAdb Database