BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1930
NameColumbamine chloride
Pubchem ID15840198
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight373.83
Exact mass373.108086
Molecular formulaC20H20ClNO4
XlogPN/A
Topological Polar Surface Area51.8
H-Bond Donor1
H-Bond Acceptor5
Rotational Bond Count3
IUPAC Name3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-olchloride
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC.[Cl-]
Isomeric SMILEN/A
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