BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1092
NameAIDS010671
Pubchem ID430430
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight664.79
Exact mass664.314852
Molecular formulaC40H44N2O7
XlogP6.4
Topological Polar Surface Area71.1
H-Bond Donor0
H-Bond Acceptor9
Rotational Bond Count8
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)OC5=C6CC7C8=C(C6=C(C=C5)OC)C(=C(C=C8CCN7C)OC)OC)OC)OC
Isomeric SMILEN/A
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