BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2738
NameN-Allylnorapomorphine hydrochloride
Pubchem ID15135
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight329.82
Exact mass329.118257
Molecular formulaC19H20ClNO2
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 SMILEC=CC[NH+]1CCC2=CC=CC3=C2C1CC4=C3C(=C(C=C4)O)O.[Cl-]
Isomeric SMILEC=CC[NH+]1CCC2=CC=CC3=C2[C@@H]1CC4=C3C(=C(C=C4)O)O.[Cl-]
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