SMILES:
CCC1=CC=C(C=C1)OC(=O)C
Aroma Description:
anisic, balsamic, black, chocolate, cocoa, dark, floral, honey, licorice, rose, sweet1
SMILES:
CCC1=CC=C(C=C1)OC(=O)C
Aroma Description:
anisic, balsamic, black, chocolate, cocoa, dark, floral, honey, licorice, rose, sweet
| Receptor | Expr.% | Agonist? | Dock Score | Known agonist | Correlated Perceptual Qualities |
|---|
Dock Score is a measure of how strongly the algorithm thinks the odorant is likely to be an agonist of the receptor.
Receptors in italics are "orphans", i.e. receptors whose agonists have not been identified experimentally.
1.) The Good Scents Company
2.) Christiane Geithe, Franziska Noe, Johanna Kreissl, Dietmar Krautwurst, The Broadly Tuned Odorant Receptor OR1A1 is Highly Selective for 3-Methyl-2,4-nonanedione, a Key Food Odorant in Aged Wines, Tea, and Other Foods, Chemical Senses, Volume 42, Issue 3, 1 March 2017, Pages 181–193, https://doi.org/10.1093/chemse/bjw117