SMILES:
CC1(OCCO1)CC(OCC)=O
Aroma Description:
apple, fruity, green, plum, sweet, tropical, woody1
| Receptor | Expression | log10 EC50 | Adj. Top | Antagonist? | Correlated Perceptual Qualities |
|---|---|---|---|---|---|
| OR5AC2 | 76 | -5.9 2 | 7 2 | cotton_candy, carnation, berry, sweet, chocolate, strawberry, caramellic, plum, clove, natural | |
| OR2T34 | ? | -5.3 2 | 6 2 | fennel, candy, sweet, anise, apple, plum, ozone, warm, chocolate, cinnamon | |
| OR2M4 | 96 | -4 2 | 5 2 | fennel, naphthyl, anise, narcissus, sweet | |
| OR5A1 | 100 | - | 0 3 | ||
| OR5A2 | 100 | - | 0 3 | ||
| OR5AN1 | 100 | - | 0 3 |
SMILES:
CC1(OCCO1)CC(OCC)=O
Aroma Description:
apple, fruity, green, plum, sweet, tropical, woody
| 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.) D. Gonzalez-Kristeller, J.B.P. do Nascimento, P.A.F. Galante, B. Malnic, Identification of agonists for a group of human odorant receptors, Front. Pharmacol. 6 (2015)
3.) Keiichi Yoshikawa, Jun Deguchi, Hu Jieying et al. Diverse yet selective tuning of an odorant receptor for sensing four classes of musk compounds, 03 August 2022, PREPRINT (Version 1) available at Research Square [https://doi.org/10.21203/rs.3.rs-1916850/v1]