SMILES:
CC(C)CCOC(=O)C
Aroma Description:
banana, fruity, solvent, sweet1
| Receptor | log10 EC50 | Adj. Top | Antagonist? | Correlated Perceptual Qualities |
|---|---|---|---|---|
| OR1G1 | - | 4.1624 2, 5 4, 4.0506 5 | waxy, tart, orange, sweet, aldehydic, medicinal, citrus, clean, fresh, anise | |
| OR2AG1 | - | 8.617 3 | galbanum, green_pea, honey, heliotrope, banana, bell_pepper, solvent | |
| OR2W1 | -4.21 6 | - | sweet, herbal, tart, fatty, orange, passionfruit, fresh, mimosa, rancid, mushroom | |
| OR52D1 | - | 4.7716 2 | anise, cheesy, rancid, orange, dairy, sour, sweet, tart, sharp, pineapple | |
| OR1A1 | - | 0 6 |
SMILES:
CC(C)CCOC(=O)C
Aroma Description:
banana, fruity, solvent, sweet
| Receptor | Docking Score | Correlated Perceptual Qualities |
|---|
1.) The Good Scents Company
2.) Guenhael Sanz, Claire Schlegel, Jean-Claude Pernollet and Loic Briand Comparison of Odorant Specificity of Two Human Olfactory Receptors from Different Phylogenetic Classes and Evidence for Antagonism Chemical Senses vol. 30 no. 1 (2005) doi:10.1093/chemse/bji002
3.) Gelis L, Wolf S, Hatt H, Neuhaus EM, Gerwert K. Prediction of a ligand-binding niche within a human olfactory receptor by combining site-directed mutagenesis with dynamic homology modeling. Angew Chem Int Ed Engl. 2012 Jan 27;51(5):1274-8. doi: 10.1002/anie.201103980. Epub 2011 Dec 5. PMID: 22144177.
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6.) Christiane Geithe, Franziska Noe, Johanna Kreissl, Dietmar Krautwurst, The Broadly Tuned Odorant Receptor OR1A1 is Highly Selective for 3-Methyl-2,4-nonanedione, a Key Food Odorant in Aged Wines, Tea, and Other Foods, Chemical Senses, Volume 42, Issue 3, 1 March 2017, Pages 181–193, https://doi.org/10.1093/chemse/bjw117