BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2553
NameLongifolonine
Pubchem ID442312
KEGG IDC09569
SourceXylopia parviflora
TypeNatural
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight297.31
Exact mass297.100108
Molecular formulaC17H15NO4
XlogP2.1
Topological Polar Surface Area79.1
H-Bond Donor2
H-Bond Acceptor5
Rotational Bond Count3
IUPAC Name(7-hydroxy-6-methoxy-3,4-dihydroisoquinolin-1-yl)-(4-hydroxyphenyl)methanone
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECOC1=C(C=C2C(=C1)CCN=C2C(=O)C3=CC=C(C=C3)O)O
Isomeric SMILEN/A
Drugpediawiki
References1. Nishiyama,Phytochem.,67,(2006),2671
2. Harborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter21
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