isoliensinine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 25
Total Number of Articles : 14
PubChem 5274591
Molecular Formula

C37H42N2O6

SMILES

CN1CCC2=CC(=C(C=C2[C@H]1CC3=CC=C(C=C3)OC)OC4=C(C=CC(=C4)C[C@@H]5C6=CC(=C(C=C6CCN5C)OC)O)O)OC

InChI

InChI=1S/C37H42N2O6/c1-38-15-13-26-20-36(44-5)37(22-29(26)30(38)16-23-6-9-27(42-3)10-7-23)45-35-18-24(8-11-32(35)40)17-31-28-21-33(41)34(43-4)19-25(28)12-14-39(31)2/h6-11,18-22,30-31,40-41H,12-17H2,1-5H3/t30-,31-/m1/s1

synonyms
  • Isoliensinine
  • 6817-41-0
  • (1R)-1-[[4-hydroxy-3-[[(1R)-6-methoxy-1-[(4-methoxyphenyl)methyl]-2-methyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]phenyl]methyl]-6-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-7-ol
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Properties
Property Value
MW 610.7 g/mol
HBD 2
HBA 8
Rotatable Bond Count 9
Exact Mass 610.30428706 g/mol
Monoisotopic Mass 610.30428706 g/mol
Heavy Atom Count 45
Isotope Atom Count 0
Atom Stereo Count 2
Covalent Unit Count 1
Complexity 917
xlogp 6.4
Topological Polar Surface Area 83.9