Record No. 1 of 1

ID3111
NameRoemerine
Pubchem ID119204
KEGG IDN/A
SourceHornschuchia obliqua
TypeNatural
FunctionAdrenergic alpha-blocker
Drug Like PropertiesYes
Molecular Weight279.33
Exact mass279.125929
Molecular formulaC18H17NO2
XlogP3.3
Topological Polar Surface Area21.7
H-Bond Donor0
H-Bond Acceptor3
Rotational Bond Count0
IUPAC NameN/A
Structure
   
SDF file
MOL file
PDB file
Canonical SMILECN1CCC2=CC3=C(C4=C2C1CC5=CC=CC=C54)OCO3
Isomeric SMILECN1CCC2=CC3=C(C4=C2[C@H]1CC5=CC=CC=C54)OCO3
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