SMILES:
CC(=O)OCCCCCCC
Aroma Description:
aldehydic, apricot, citrus, fatty, fresh, fruit, green, pear, ripe, rummy, waxy, winey, woody1
SMILES:
CC(=O)OCCCCCCC
Aroma Description:
aldehydic, apricot, citrus, fatty, fresh, fruit, green, pear, ripe, rummy, waxy, winey, woody
| 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).