BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1258
NameBackebergine
Pubchem ID177578
KEGG IDC09348
SourceXylopia parviflora
TypeNatural
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight189.21
Exact mass189.078979
Molecular formulaC11H11NO2
XlogP2
Topological Polar Surface Area31.4
H-Bond Donor0
H-Bond Acceptor3
Rotational Bond Count2
IUPAC Name6,7-dimethoxyisoquinoline
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C=C2C=NC=CC2=C1)OC
Isomeric SMILEN/A
Drugpediawiki
References1. Nishiyama,Phytochem.,65,(2004),939
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
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