BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1786
NameCis-N-methyl-alpha-berbine
Pubchem ID11953853
KEGG IDC05318
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight250.36
Exact mass250.159575
Molecular formulaC18H20N+
XlogP3.4
Topological Polar Surface Area0
H-Bond Donor0
H-Bond Acceptor0
Rotational Bond Count0
IUPAC Name(7S,13aS)-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]12CCC3=CC=CC=C3C1CC4=CC=CC=C4C2
Isomeric SMILEC[N@@+]12CCC3=CC=CC=C3[C@@H]1CC4=CC=CC=C4C2
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