SMILES:
O=C1CCCCCCC/C=C\CCCCCCC1
Aroma Description:
clean, musk, dry, animal, sweet1
Receptor | log10 EC50 | Adj. Top | Antagonist? | Correlated Perceptual Qualities |
---|---|---|---|---|
OR5AN1 | -2.75 2, -6.06 4 | 3.0597 2, 2.5 3, 9.2857 4 | musk, animal, powdery | |
OR5A2 | - | 2.5 3 | musk, animal | |
OR4K2 | - | 0.5769 5 | storax, animal, clove, cortex, malty, musk, natural, foliage, almond, powdery | |
OR10Q1 | - | 0.1923 5 | natural, orangeflower, powdery, neroli, animal, musk, naphthyl | |
OR4P4 | - | 0.1923 5 | cloth, laundered | |
OR5A1 | - | 0 3 | ||
OR5I1 | - | 0 5 | ||
OR5K1 | - | -0.4065 6 | ||
OR5P3 | - | -0.4065 6 | ||
OR8H1 | - | -0.4065 6 | ||
OR2W1 | - | -0.6504 6 |
SMILES:
O=C1CCCCCCC/C=C\CCCCCCC1
Aroma Description:
clean, musk, dry, animal, sweet
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.) Ahmed, Lucky et al "Molecular mechanism of activation of human musk receptors OR5AN1 and OR1A1 by (R)-muscone and diverse other musk-smelling compounds." Proceedings of the National Academy of Sciences 115.17 (2018): E3950-E3958. Web. 29 Aug. 2021.
3.) 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]
4.) Omura M, Takabatake Y, Lempert E, Benjamin-Hong S, D'Hulst C, Feinstein P. A genetic platform for functionally profiling odorant receptors in olfactory cilia ex vivo. Sci Signal. 2022 Aug 9;15(746):eabm6112. doi: 10.1126/scisignal.abm6112. Epub 2022 Aug 9. PMID: 35944068.
5.) Ashti Baghaei, K. (2015). Large scale analysis of olfactory receptors with highly genetically variations in relation with specific anosmia (Doctoral dissertation, Bochum, Ruhr-Universität Bochum, Diss., 2013).
6.) Aya Kato, Naoko Saito (2015) Odor control agent. JP5798382B2