BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1838
NameCODEINE PHOSPHATE
Pubchem ID24848031
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight913.90
Exact mass912.376057
Molecular formulaC47H63Cl2N4O8P
XlogPN/A
Topological Polar Surface Area168
H-Bond Donor8
H-Bond Acceptor12
Rotational Bond Count8
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECC1=CC=C(C=C1)C(=CCN2CCCC2)C3=CC=CC=N3.CC(C(C1=CC=CC=C1)O)NC.CN1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O.OP(=O)(O)O.Cl.Cl
Isomeric SMILECC1=CC=C(C=C1)/C(=CCN2CCCC2)/C3=CC=CC=N3.CC(C(C1=CC=CC=C1)O)NC.CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.OP(=O)(O)O.Cl.Cl
Drugpediawiki
References1. Source  
2. Function  
3. All Records