2D Structure
3D Structure
| Properties | |
|---|---|
| PID | PID00170 |
| Mol. Weight | 86.134 g/mol |
| LogP | 1.15 |
| Water solubility | 90.1 mg/mL |
| Hydrogen Bond Donor | 1 |
| Hydrogen Bond Acceptor | 1 |
| Rotatable Bonds | 2 |
| XLogP3-AA | 1.1 |
| Identifiers | |
|---|---|
| Formula | C5H10O |
| PubChem CID | 12020 |
| FEMA | 3584 |
| Flavor Profile | Butter, Fish, Green, Oxidized, Wet Earth |
| Smiles | C=CC(O)CC |
| InChl Key | VHVMXWZXFBOANQ-UHFFFAOYSA-N |
| InChl | InChI=1S/C5H10O/c1-3-5(6)4-2/h3,5-6H,1,4H2,2H3 |
| CAS Registry Number | 616-25-1 |
| IUPAC Systematic Name | pent-1-en-3-ol |
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 |
1-Penten-3-Ol,colorless to light yellow liquid with fruity aroma.Slightly soluble in water.Flammable liquids.Used as a flavoring in food.Natural products are found in oranges, strawberries, tomatoes, etc.
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. Bijlsma-Meeles E. Viability in Drosophila melanogaster in relation to age and ADH activity of eggs transferred to ethanol food[J]. Heredity, 1979, 42(1): 79.
2. Jiang, C., Gibson, J. B., Wilks, A. V., Freeth, A. L.Restriction endonuclease variation in the region of the alcohol dehydrogenase gene: a comparison of null and normal alleles 3. from natural populations of Drosophila melanogaster[J]. Heredity, 1988, 60(1): 101.
4. Takai, H., Ozawa, R., Takabayashi, J., Fujii, S., Arai, K., Ichiki, R. T., ... Kobayashi, J.Silkworms suppress the release of green leaf volatiles by mulberry leaves with an enzyme from their spinnerets[J]. Scientific reports, 2018, 8(1): 11942.
5. Nestl, B. M., Geinitz, C., Popa, S., Rizek, S., Haselbeck, R. J., Stephen, R., ... Man, H.Structural and functional insights into asymmetric enzymatic dehydration of alkenols[J]. Nature chemical biology, 2017, 13(3): 275.
6. Klee H J, Tieman D M. The genetics of fruit flavour preferences[J]. Nature Reviews Genetics, 2018: 1.
7. http://www.chemspider.com/Chemical-Structure.11525.html
8. https://www.chemicalbook.com/ProductChemicalPropertiesCB3335017.htm