BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1029
Name2,3,9,10-Tetrahydroxyberbine
Pubchem ID443767
KEGG IDC12330
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight299.32
Exact mass299.115758
Molecular formulaC17H17NO4
XlogP1.9
Topological Polar Surface Area84.2
H-Bond Donor4
H-Bond Acceptor5
Rotational Bond Count0
IUPAC Name6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinoline-2,3,9,10-tetrol
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC1CN2CC3=C(CC2C4=CC(=C(C=C41)O)O)C=CC(=C3O)O
Isomeric SMILEN/A
Drugpediawiki
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