BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1269
NameBenzyltetrahydropalmatine
Pubchem ID3082684
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionAntiarrhythmic
Drug Like PropertiesNo
Molecular Weight445.55
Exact mass445.225308
Molecular formulaC28H31NO4
XlogP5.2
Topological Polar Surface Area40.2
H-Bond Donor0
H-Bond Acceptor5
Rotational Bond Count6
IUPAC Name2,3,9,10-tetramethoxy-8-(phenylmethyl)-6,8,13,13a-tetrahydro-5H-isoquinolino[3,2-a]isoquinoline
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C2=C(CC3C4=CC(=C(C=C4CCN3C2CC5=CC=CC=C5)OC)OC)C=C1)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Source  
2. Function  
3. All Records