BIADB: A Database for Benzylisoquinoline Alkaloids

Record No - 1 of 1
ID2278
NameHomocoralyne sulfopropionate
Pubchem ID40154
KEGG IDN/A
SourceN/A
TypeUnknown
FunctionUnknown
Drug Like PropertiesNo
Molecular Weight531.57
Exact mass531.156302
Molecular formulaC26H29NO9S
XlogPN/A
Topological Polar Surface Area125
H-Bond Donor0
H-Bond Acceptor9
Rotational Bond Count7
IUPAC Name8-ethyl-2,3,10,11-tetramethoxyisoquinolino[3,2-a]isoquinolin-7-ium;propanoyl sulfate
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECCC1=C2C=C(C(=CC2=CC3=[N+]1C=CC4=CC(=C(C=C43)OC)OC)OC)OC.CCC(=O)OS(=O)(=O)[O-]
Isomeric SMILEN/A
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