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Asarinin
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NAMES
  • ASARININ
  • Episesamin
SMILES
c1cc2c(cc1[C@H]1OC[C@@H]3[C@H](c4ccc5c(c4)OCO5)OC[C@H]13)OCO2
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
MOLECULAR FORMULA
C20H18O6
CROSS REFERENCES
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Asarinin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 354.11
AlogP 3.22
HBond donors 0
HBond acceptors 6
Atoms 44
Contains toxicophore No
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Asarinin.