BIAdb DL-Laudanine 2051
From DrugPedia: A Wikipedia for Drug discovery
{{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
Stephania aculeata
[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