BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1965
NameCularidine
Pubchem ID442203
KEGG IDC09400
SourceDicentra cucullaria
TypeNatural
FunctionCytotoxic
Drug Like PropertiesYes
Molecular Weight327.37
Exact mass327.147058
Molecular formulaC19H21NO4
XlogP3
Topological Polar Surface Area51.2
H-Bond Donor1
H-Bond Acceptor5
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=C3C1CC4=CC(=C(C=C4OC3=C(C=C2)O)OC)OC
Isomeric SMILECN1CCC2=C3[C@@H]1CC4=CC(=C(C=C4OC3=C(C=C2)O)OC)OC
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
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