Record No. 1 of 1

ID1979
NameCycleanine
Pubchem ID121313
KEGG IDN/A
SourceStephania epigeae
TypeNatural
FunctionAntiplasmodial
Drug Like PropertiesNo
Molecular Weight622.75
Exact mass622.304287
Molecular formulaC38H42N2O6
XlogP6.7
Topological Polar Surface Area61.9
H-Bond Donor0
H-Bond Acceptor8
Rotational Bond Count4
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC(=C(C3=C2C1CC4=CC=C(C=C4)OC5=C6C(CC7=CC=C(O3)C=C7)N(CCC6=CC(=C5OC)OC)C)OC)OC
Isomeric SMILECN1CCC2=CC(=C(C3=C2[C@H]1CC4=CC=C(C=C4)OC5=C6[C@@H](CC7=CC=C(O3)C=C7)N(CCC6=CC(=C5OC)OC)C)OC)OC
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