BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2935
NamePholcodine
Pubchem ID5359422
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionAnalgesic
Drug Like PropertiesYes
Molecular Weight398.50
Exact mass398.220557
Molecular formulaC23H30N2O4
XlogP0.8
Topological Polar Surface Area54.4
H-Bond Donor1
H-Bond Acceptor6
Rotational Bond Count4
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC23C4C1CC5=C2C(=C(C=C5)OCCN6CCOCC6)OC3C(C=C4)O
Isomeric SMILECN1CC[C@]23[C@@H]4[C@H](C=CC2[C@H]1CC5=C3C(=C(C=C5)OCCN6CCOCC6)O4)O
Drugpediawiki
References1. Source  
2. Function  
3. All Records