2D Structure
3D Structure
| Properties | |
|---|---|
| PID | PID00146 |
| Mol. Weight | 252.398 g/mol |
| LogP | 5.12 |
| Water solubility | 0.00000186 mol/L at 20 °C |
| Hydrogen Bond Donor | 0 |
| Hydrogen Bond Acceptor | 2 |
| Rotatable Bonds | 0 |
| XLogP3-AA | 5.5 |
| Identifiers | |
|---|---|
| Formula | C16H28O2 |
| PubChem CID | 5317881 |
| FEMA | - |
| Flavor Profile | None |
| Smiles | O=C1CCCCCC=CCCCCCCCCO1 |
| InChl Key | NVIPUOMWGQAOIT-DUXPYHPUSA-N |
| InChl | InChI=1S/C16H28O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h2,4H,1,3,5-15H2/b4-2+ |
| CAS Registry Number | None |
| IUPAC Systematic Name | (8E)-1-oxacycloheptadec-8-en-2-one |
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 |
|---|---|---|---|---|---|
| Cacumen Tamaricis | Xi He Liu(西河柳) | Chinese Tamarisk Twig | Mild,Pungent,Sweet | Lung,Stomach,Heart | View Graph |
Ambrettolide is naturally occurring biochemicals.
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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