BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1834
NameCodeine methochloride
Pubchem ID5745709
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight349.85
Exact mass349.144471
Molecular formulaC19H24ClNO3
XlogPN/A
Topological Polar Surface Area38.7
H-Bond Donor1
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[N+]1(CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O)C.[Cl-]
Isomeric SMILEC[N+]1(CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O)C.[Cl-]
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