BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2895
NamePalmatine chloride hydrate
Pubchem ID16212317
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight405.87
Exact mass405.134301
Molecular formulaC21H24ClNO5
XlogPN/A
Topological Polar Surface Area41.8
H-Bond Donor1
H-Bond Acceptor6
Rotational Bond Count4
IUPAC Name2,3,9,10-tetramethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-iumchloride hydrate
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)OC)OC.O.[Cl-]
Isomeric SMILEN/A
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