BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID3199
NameSanguinarine analogue,13
Pubchem ID25093267
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight251.28
Exact mass251.094629
Molecular formulaC16H13NO2
XlogP3.9
Topological Polar Surface Area31.4
H-Bond Donor0
H-Bond Acceptor3
Rotational Bond Count0
IUPAC Name2,2-dimethyl-[1,3]dioxolo[4,5-i]phenanthridine
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECC1(OC2=C(O1)C3=C(C=C2)C4=CC=CC=C4N=C3)C
Isomeric SMILEN/A
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