BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1248
NameAtheroline,O-ethyl-
Pubchem ID632565
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight365.38
Exact mass365.126323
Molecular formulaC21H19NO5
XlogP3.8
Topological Polar Surface Area66.9
H-Bond Donor0
H-Bond Acceptor6
Rotational Bond Count5
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECCOC1=C(C=C2C(=C1)C(=O)C3=NC=CC4=CC(=C(C2=C43)OC)OC)OC
Isomeric SMILEN/A
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