SMILES:
CC1([C@@H]2CC[C@]1([C@@]3(C2)(O))C)C.C3
Aroma Description:
earthy, musty1
SMILES:
CC1([C@@H]2CC[C@]1([C@@]3(C2)(O))C)C.C3
Aroma Description:
earthy, musty
| 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.) Son, M., D. G. Cho, J. H. Lim, J. Park, S. Hong, H. J. Ko, and Park, T. H. (2015) Real-time monitoring of geosmin and 2- methylisoborneol, representative odor compounds in water pollution using bioelectronic nose with human-like performance, Biosens. Bioelectron., 74: 199–206.
3.) Aya Kato, Naoko Saito (2017) Search method for mold odor inhibitor JP6104058B2