BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2710
NameMorphine 6-nicotinate
Pubchem ID5488579
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesYes
Molecular Weight390.43
Exact mass390.157957
Molecular formulaC23H22N2O4
XlogP1.9
Topological Polar Surface Area71.9
H-Bond Donor1
H-Bond Acceptor6
Rotational Bond Count3
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC23C4C1CC5=C2C(=C(C=C5)O)OC3C(C=C4)OC(=O)C6=CN=CC=C6
Isomeric SMILECN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)OC(=O)C6=CN=CC=C6
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