epiberberine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 43
Total Number of Articles : 19
PubChem 160876
Molecular Formula

C20H18NO4+

SMILES

COC1=C(C=C2C(=C1)CC[N+]3=C2C=C4C=CC5=C(C4=C3)OCO5)OC

InChI

InChI=1S/C20H18NO4/c1-22-18-8-13-5-6-21-10-15-12(3-4-17-20(15)25-11-24-17)7-16(21)14(13)9-19(18)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1

synonyms
  • Epiberberine
  • 6873-09-2
  • VWP9N35AYS
Click to show/hide the synonyms
Properties
Property Value
MW 336.4 g/mol
HBD 0
HBA 4
Rotatable Bond Count 2
Exact Mass 336.12358306 g/mol
Monoisotopic Mass 336.12358306 g/mol
Heavy Atom Count 25
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 488
xlogp 3.6
Topological Polar Surface Area 40.8