BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2790
NameN-n-Butylnorapomorphine hydrochloride
Pubchem ID3032993
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight345.86
Exact mass345.149557
Molecular formulaC20H24ClNO2
XlogPN/A
Topological Polar Surface Area44.9
H-Bond Donor3
H-Bond Acceptor3
Rotational Bond Count3
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECCCC[NH+]1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O.[Cl-]
Isomeric SMILECCCC[NH+]1CCC2=CC=CC3=C2[C@H]1CC4=C3C(=C(C=C4)O)O.[Cl-]
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