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Amygdalin
FEATURES
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NAMES
  • Amygdalin
SMILES
N#C[C@H](O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1
InChI
InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20+/m0/s1
MOLECULAR FORMULA
C20H27NO11
CROSS REFERENCES
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Amygdalin

Compound Synopsis

OVERVIEW
PROPERTIES
Molecular weight 457.16
AlogP -3.11
HBond donors 7
HBond acceptors 12
Atoms 59
Contains toxicophore Yes
Contains PAINS No
Commercially available Yes
Property color indications are based on Lipinski's Ro5.
PROTEIN TARGETS
No information about proteins targeted by Amygdalin.