sesamin

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 343
Total Number of Articles : 185
PubChem 72307
Molecular Formula

C20H18O6

SMILES

C1[C@H]2[C@H](CO[C@@H]2C3=CC4=C(C=C3)OCO4)[C@H](O1)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2/t13-,14-,19+,20+/m0/s1

synonyms
  • sesamin
  • 607-80-7
  • Fagarol
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Properties
Property Value
MW 354.4 g/mol
HBD 0
HBA 6
Rotatable Bond Count 2
Exact Mass 354.11033829 g/mol
Monoisotopic Mass 354.11033829 g/mol
Heavy Atom Count 26
Isotope Atom Count 0
Atom Stereo Count 4
Covalent Unit Count 1
Complexity 482
xlogp 2.7
Topological Polar Surface Area 55.4