gamma-decalactone

SMILES:
CCCCCCC1CCC(=O)O1

Aroma Description:
fresh, oily, waxy, peach, coconut, buttery, sweet¹

Receptor	log10 EC₅₀	Adj. Top	Correlated Perceptual Qualities
OR1G1	-	9.4924 ²	waxy, tart, orange, sweet, aldehydic, fresh, citrus, clean, medicinal, anise
OR2W1	-4.103 ⁵	-	fatty, sweet, herbal, cucumber, orange, tart, mimosa, spicy, coumarinic, passionfruit
OR1D2	-3.75 ³	-	rose, peach, bois_de_rose, citrus, floral, fresh, lactonic, waxy, lime, blueberry
OR52D1	-	0.203 ²	anise, cheesy, orange, sweet, dairy, sour, rancid, waxy, tart, sharp
OR5A1	-	0 ⁴
OR5A2	-	0 ⁴
OR5AN1	-	0 ⁴

SMILES:
CCCCCCC1CCC(=O)O1

Aroma Description:
fresh, oily, waxy, peach, coconut, buttery, sweet

Receptor	Agonist?	Dock Score	Pose1	LSRB - LSP	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.
LSP: Ligand Surface Polarity, i.e. how much of the ligand's surface is hydrophilic.
LSRB: Ligand Surface Receptor Binding, i.e. how much of the ligand's surface interacts with receptor atoms.

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.) Veithen, A.; Wilin, F.; Philippeau, M.; Chatelain, P. OR1D2 is a broadly tuned human olfactory receptor. Chem. Senses 2015, 40, 262–263.

4.) Keiichi Yoshikawa, Jun Deguchi, Hu Jieying et al. Diverse yet selective tuning of an odorant receptor for sensing four classes of musk compounds, 03 August 2022, PREPRINT (Version 1) available at Research Square [https://doi.org/10.21203/rs.3.rs-1916850/v1]

5.) Franziska Haag, Antonella Di Pizio, Dietmar Krautwurst, The key food odorant receptive range of broadly tuned receptor OR2W1. Food Chemistry 375 (2022) 131680

primaryodors.org