SMILES:
CCCCCC(=O)OCCCCC
Aroma Description:
sweet, green, fruity, estery, pineapple, apple, pear, fatty, waxy, cognac, melon1
| Receptor | log10 EC50 | Adj. Top | Antagonist? | Correlated Perceptual Qualities |
|---|---|---|---|---|
| OR10G3 | - | 0 2 | ||
| OR10J5 | - | 0 2, 0 3 | ||
| OR11A1 | - | 0 2 | ||
| OR1C1 | - | 0 2 | ||
| OR2A25 | - | 0 2 | ||
| OR2B11 | - | 0 2 | ||
| OR2J2 | - | 0 2, 0 3 | ||
| OR2J3 | - | 0 2 | ||
| OR2W1 | - | 0 2, 0 3 | ||
| OR51E1 | - | 0 2, 0 3 | ||
| OR51L1 | - | 0 2, 0 3 | ||
| OR56A4 | - | 0 2 | ||
| OR5K1 | - | 0 2 | ||
| OR8D1 | - | 0 2 | ||
| OR8K3 | - | 0 2 | ||
| OR2C1 | - | 0 3 | ||
| OR10G7 | - | -0.0667 2 | ||
| OR1A1 | - | -1.1667 2, 0 3 | ||
| OR5P3 | - | -2.6 2, 0 3 |
SMILES:
CCCCCC(=O)OCCCCC
Aroma Description:
sweet, green, fruity, estery, pineapple, apple, pear, fatty, waxy, cognac, melon
| Receptor | Dock Score | Affinity | A100 | Correlated Perceptual Qualities |
|---|
Dock Score: This is a measure of whether the algorithm thinks the odorant is an agonist of the receptor.
Affinity: The binding affinity, in kJ/mol, of the ligand docked in the active or inactive model, whichever is greater.
A100: A measure of the degree of activation of the receptor. See
Ibrahim et al (2019).
1.) The Good Scents Company
2.) Adipietro KA, Mainland JD, Matsunami H (2012) Functional Evolution of Mammalian Odorant Receptors. PLoS Genet 8(7): e1002821. doi:10.1371/ journal.pgen.1002821
3.) Saito H, Chi Q, Zhuang H, Matsunami H, Mainland JD. Odor coding by a Mammalian receptor repertoire. Sci Signal. 2009 Mar 3;2(60):ra9. doi: 10.1126/scisignal.2000016. PMID: 19261596; PMCID: PMC2774247.