BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID1562
NameBisoltus
Pubchem ID24892867
KEGG IDD07740
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight335.83
Exact mass335.128821
Molecular formulaC18H22ClNO3
XlogPN/A
Topological Polar Surface Area43.1
H-Bond Donor2
H-Bond Acceptor4
Rotational Bond Count1
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILEC[NH+]1CCC23C4C1CC5=C2C(=C(C=C5)OC)OC3C(C=C4)O.[Cl-]
Isomeric SMILEC[NH+]1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O.[Cl-]
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