BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2302
NameIsoapocodeine
Pubchem ID217214
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight281.35
Exact mass281.141579
Molecular formulaC18H19NO2
XlogP2.6
Topological Polar Surface Area32.7
H-Bond Donor1
H-Bond Acceptor3
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)OC
Isomeric SMILECN1CCC2=CC=CC3=C2[C@H]1CC4=C3C(=C(C=C4)O)OC
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