2D Structure
3D Structure
| Properties | |
|---|---|
| PID | PID00202 |
| Mol. Weight | 138.21 g/mol |
| LogP | 2.62 |
| Water solubility | 0.000871 mol/L at 20 °C |
| Hydrogen Bond Donor | 0 |
| Hydrogen Bond Acceptor | 1 |
| Rotatable Bonds | 5 |
| XLogP3-AA | 2.7 |
| Identifiers | |
|---|---|
| Formula | C9H14O |
| PubChem CID | 6429282 |
| FEMA | - |
| Flavor Profile | Geranium, Pungent |
| Smiles | CCCCC=CC=CC=O |
| InChl Key | ZHHYXNZJDGDGPJ-IGTJQSIKSA-N |
| InChl | InChI=1S/C9H14O/c1-2-3-4-5-6-7-8-9-10/h5-9H,2-4H2,1H3/b6-5-,8-7+ |
| CAS Registry Number | 21661-99-4 |
| IUPAC Systematic Name | (2E,4Z)-nona-2,4-dienal |
Organ Location Map/System Distribution of Pungent Flavor Compounds’ Targets
Note: Known Targets (Gene) from 6952 literatures, DrugBank (http://www.drugbank.ca/), STITCH (http://stitch.embl.de/), ChEMBL (https://www.ebi.ac.uk/chembl/), Therapeutic Target Database (http://bidd.nus.edu.sg/group/ttd/), and Comparative Toxicogenomics Database (CTD, http://ctdbase.org/)
| English Name | Pinyin Name (Chinese Name) | Latin Name | Properties in TCM | merdians | View Graph |
|---|---|---|---|---|---|
| NONE | NONE | NONE | NONE | NONE | View Graph |
NO DATA
Note: Click anywhere in the blank, you can drag the whole dynamic diagram. Click on a node, you can drag his location to see it more clearly. The blue circle represents pharmacology, toxicology, or daily use. Orange hexagon represents the pungent compounds.
1．Cheong S, Clomburg J M, Gonzalez R. Energy-and carbon-efficient synthesis of functionalized small molecules in bacteria using non-decarboxylative Claisen condensation reactions[J]. Nature biotechnology, 2016, 34(5): 556.
2．Wang, Y., Sun, J., Zhong, H., Li, N., Xu, H., Zhu, Q., & Liu, Y. Effect of probiotics on the meat flavour and gut microbiota of chicken[J]. Scientific reports, 2017, 7(1): 6400.
3．Zhang, Y., Yang, N., Fray, R. G., Fisk, I., Liu, C., Li, H., & Han, Y. Characterization of volatile aroma compounds after in-vial cooking of foxtail millet porridge with gas chromatography-mass spectrometry[J]. Journal of Cereal Science, 2018, 82: 8-15.
4．Bornscheuer, U. T., Huisman, G. W., Kazlauskas, R. J., Lutz, S., Moore, J. C., & Robins, K. Engineering the third wave of biocatalysis[J]. Nature, 2012, 485(7397): 185.
5．Suriyaphan O, Drake M A, Cadwallader K R. Lipid oxidation of deoiled soy lecithin by lactic acid bacteria[J]. LWT-Food Science and Technology, 2001, 34(7): 462-468.
6．Nobrega, I. C., Ataíde, C. S., Moura, O. M., Livera, A. V., & Menezes, P. H. Volatile constituents of cooked bullfrog (Rana catesbeiana) legs[J]. Food Chemistry, 2007, 102(1): 186-191.
7．Oueslati, I., Manaï, H., Madrigal-Martínez, M., Martínez-Cañas, M. A., Sánchez-Casas, J., Zarrouk, M., & Flamini, G. Volatile molecular markers of VOO Thermo-oxidation: Effect of heating processes, macronutrients composition, and olive ripeness on the new emitted aldehydic compounds[J]. Food research international, 2018, 106: 654-665.
8．Duan, Y., Zheng, F., Chen, H., Huang, M., Xie, J., Chen, F., & Sun, B.. Analysis of volatiles in Dezhou Braised Chicken by comprehensive two-dimensional gas chromatography/high resolution-time of flight mass spectrometry[J]. LWT-Food Science and Technology, 2015, 60(2): 1235-1242.
9．Zhang, Y., Yang, N., Fray, R. G., Fisk, I., Liu, C., Li, H., & Han, Y Characterization of volatile aroma compounds after in-vial cooking of foxtail millet porridge with gas chromatography-mass spectrometry[J]. Journal of Cereal Science, 2018, 82: 8-15.