SMILES:
CCCC(=CC(=O)[O-])C
Aroma Description:
cheesy, fruity1
| Receptor | log10 EC50 | Adj. Top | Antagonist? | Correlated Perceptual Qualities |
|---|---|---|---|---|
| OR51B2 | -4.4 3, -4.7 4 | 10 3, 10 4 | cheesy | |
| OR51I2 | -4.52 4, -4.42 5 | 5 4, 8.3 5 | cheesy, sour, sweaty, sharp, acidic | |
| OR1A1 | -3.92 4 | 4.6 4 | herbal, caraway, passionfruit, spearmint, weedy, orange, hay, fresh, waxy, citrus | |
| OR2W1 | -4.22 4 | 0.8 4 | fatty, sweet, herbal, cucumber, orange, tart, mimosa, spicy, coumarinic, passionfruit | |
| OR2J1 | -4.53 2 | 0.0573 2 | tonka, coumarinic, hay | |
| OR51E1 | -4.22 4 | 0.48 4 | cheesy, sweaty, sour, acidic | |
| OR10A6 | -3.92 4 | 0.76 4 | floral, honey, rhubarb, neroli, cyclamen, cinnamyl, hyacinth, rose, dirty, balsamic |
SMILES:
CCCC(=CC(=O)[O-])C
Aroma Description:
cheesy, fruity
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.) Mainland JD, Li YR, Zhou T, Liu WL, Matsunami H. Human olfactory receptor responses to odorants. Sci Data. 2015 Feb 3;2:150002. doi: 10.1038/sdata.2015.2. PMID: 25977809; PMCID: PMC4412152.
3.) Li B, Kamarck ML, Peng Q, Lim FL, Keller A, et al. (2022) From musk to body odor: Decoding olfaction through genetic variation. PLOS Genetics 18(2): e1009564. https://doi.org/10.1371/journal.pgen.1009564
4.) Aya Kato, Naoko Saito (2018) Search method for odor control agent JP6422665B2
5.) Chatelain Pierre, Veithen Alex, Olfactory Receptors involved in the perception of sweat carboxylic acids and the use thereof. WO 2014/191047