BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1963
NameCularicine
Pubchem ID442201
KEGG IDC09398
SourceCorydalis claviculata
TypeNatural
FunctionCytotoxic
Drug Like PropertiesYes
Molecular Weight311.33
Exact mass311.115758
Molecular formulaC18H17NO4
XlogP2.8
Topological Polar Surface Area51.2
H-Bond Donor1
H-Bond Acceptor5
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=C3C1CC4=CC5=C(C=C4OC3=C(C=C2)O)OCO5
Isomeric SMILECN1CCC2=C3[C@@H]1CC4=CC5=C(C=C4OC3=C(C=C2)O)OCO5
Drugpediawiki
References1. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
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