BIAdb DL-Laudanine 2049

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Show 2-D Structure

{{Drugbox | IUPAC_name =5-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenol | PubChem = 442304 | DrugBank = | ChemSpiderID = | chemical_formula =C20H25NO4 | molecular_weight = 343.4168 | smiles = CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)OC)OC | synonyms = | density = | melting_point = | boiling_point = | solubility = | bioavailability = | protein_bound = | metabolism = | elimination_half-life = }}

Contents

[edit] Description

[edit] Source

Papaver somniferum

[edit] Function

Convulsions

[edit] General Properties

*Molecular Weight

343.4168

*Exact Mass

343.178358

*Molecular Formula

C20H25NO4

*IUPAC NAME

5-[[(1R)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-2-methoxyphenol

*Canonical Smiles

CN1CCC2=CC(=C(C=C2C1CC3=CC(=C(C=C3)OC)O)OC)OC

*Isomeric Smiles

CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC(=C(C=C3)OC)O)OC)OC

*XLogP

3.3

*Hydrogen bond donor

1

*Hydrogen bond acceptor

5

*Rotational Bond Count

5

*Topological Polar Surface Area

51.2

[edit] External Links

Link to BIAdb Database