BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID3082
NameReticuline,6'-methyl
Pubchem ID606045
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight343.42
Exact mass343.178358
Molecular formulaC20H25NO4
XlogP3.4
Topological Polar Surface Area62.2
H-Bond Donor2
H-Bond Acceptor5
Rotational Bond Count4
IUPAC Name1-[(5-hydroxy-4-methoxy-2-methylphenyl)methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECC1=CC(=C(C=C1CC2C3=CC(=C(C=C3CCN2C)OC)O)O)OC
Isomeric SMILEN/A
Drugpediawiki
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