BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1750
NameCID3033275
Pubchem ID3033275
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight343.85
Exact mass343.133907
Molecular formulaC20H22ClNO2
XlogPN/A
Topological Polar Surface Area44.9
H-Bond Donor3
H-Bond Acceptor3
Rotational Bond Count2
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC1CC1C[NH+]2CCC3=CC=CC4=C3C2CC5=C4C(=C(C=C5)O)O.[Cl-]
Isomeric SMILEC1CC1C[NH+]2CCC3=CC=CC4=C3[C@H]2CC5=C4C(=C(C=C5)O)O.[Cl-]
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