2D Structure
3D Structure
| Properties | |
|---|---|
| PID | PID00061 |
| Mol. Weight | 204.357 g/mol |
| LogP | 4.78 |
| Water solubility | 0.000282 mol/L at 20 °C |
| Hydrogen Bond Donor | 0 |
| Hydrogen Bond Acceptor | 0 |
| Rotatable Bonds | 3 |
| XLogP3-AA | 4.7 |
| Identifiers | |
|---|---|
| Formula | C15H24 |
| PubChem CID | 3033866 |
| FEMA | 3331 |
| Flavor Profile | Floral |
| Smiles | CC(C)=CCC/C(C)=C1\CC=C(C)CC1 |
| InChl Key | XBGUIVFBMBVUEG-CCEZHUSRSA-N |
| InChl | InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8H,5,7,9-11H2,1-4H3/b15-14+ |
| CAS Registry Number | 495-62-5, 13062-00-5, 21902-26-1 |
| IUPAC Systematic Name | (4Z)-1-methyl-4-(6-methylhept-5-en-2-ylidene)cyclohexene |
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 |
|---|---|---|---|---|---|
| Common Ginger Dried Rhizome | Gan Jiang (干姜) | Zingiberis Rhizoma | Hot, Pungent | Lung, Spleen, Stomach, Heart, Kidney | View Graph |
| Murraya paniculata [Syn. Chalcas paniculata] | Jiu Li Xiang(九里香) | Common Jasminorange Equivalent plant: Murraya pan | Neural, Bitter, Pungent | Lung | View Graph |
| Common Coltsfoot | Kuan Dong Hua(款冬花) | Farfarae Flos | Warm, Bitter, Pungent | Large Intestine, Stomach | View Graph |
| Fresh Common Ginger | Sheng Jiang (生姜) | Zingiber Rhizoma Recens | Warm, Pungent | Lung, Spleen, Stomach | View Graph |
| Haichow Elsholtzia | Xiang Ru (香薷) | Moslae Herba | Minor Warm,Pungent | Lung, Spleen, Stomach | View Graph |
Bisabolenes are a group of closely related natural chemical compounds which are classified as sesquiterpenes. Bisabolenes are intermediates in the biosynthesis of many other natural chemical compounds, including hernandulcin, a natural sweetener. -Bisabolene has a balsamic odor and is approved in Europe as a food additive. Bisabolenes are produced from farnesyl pyrophosphate (FPP) and are present in the essential oils of a wide variety of plants including cubeb, lemon and oregano.
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.
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