BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1840
NameCodeine p-toluenesulfonate ester
Pubchem ID273031
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight453.55
Exact mass453.160994
Molecular formulaC25H27NO5S
XlogP3.2
Topological Polar Surface Area65.1
H-Bond Donor0
H-Bond Acceptor6
Rotational Bond Count4
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECC1=CC=C(C=C1)S(=O)(=O)OC2C=CC3C4CC5=C6C3(C2OC6=C(C=C5)OC)CCN4C
Isomeric SMILEN/A
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