☰
 

SMILES:
CCCCCC1COCCC1OC(=O)C

Aroma Description:
floral, herbal, oily, green, jasmine, mushroom, lactonic1

Receptor log10 EC50 Adj. Top Antagonist? Correlated Perceptual Qualities
OR1G1 -4 2 -  waxy, tart, orange, sweet, aldehydic, fresh, citrus, clean, medicinal, anise
OR2T34 -3 2 -  fennel, marine, ozone, apple, candy, plum, anise, chocolate, green, warm
OR5B17 -3 2 -  ozone, marine, carnation, malty, clean, clove
 

SMILES:
CCCCCC1COCCC1OC(=O)C

Aroma Description:
floral, herbal, oily, green, jasmine, mushroom, lactonic

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.) 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)