[(2S,3Z)-1-(furan-2-yl)-4,8-dimethylnona-3,7-dien-2-yl] acetate
| Internal ID | 47c2f0ba-b647-4e1c-9278-c82bb91669ac |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohol esters |
| IUPAC Name | [(2S,3Z)-1-(furan-2-yl)-4,8-dimethylnona-3,7-dien-2-yl] acetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C17H24O3/c1-13(2)7-5-8-14(3)11-17(20-15(4)18)12-16-9-6-10-19-16/h6-7,9-11,17H,5,8,12H2,1-4H3/b14-11-/t17-/m1/s1 |
| InChI Key | BPWCJTWCEBVEOB-VWILAXROSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C17H24O3 |
| Molecular Weight | 276.40 g/mol |
| Exact Mass | 276.17254462 g/mol |
| Topological Polar Surface Area (TPSA) | 39.40 Ų |
| XlogP | 4.60 |
| There are no found synonyms. |
![2D Structure of [(2S,3Z)-1-(furan-2-yl)-4,8-dimethylnona-3,7-dien-2-yl] acetate](https://plantaedb.com/storage/docs/compounds/2023/11/2s3z-1-furan-2-yl-48-dimethylnona-37-dien-2-yl-acetate.jpg "2D Structure of [(2S,3Z)-1-(furan-2-yl)-4,8-dimethylnona-3,7-dien-2-yl] acetate")
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.04% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.75% | 98.95% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 93.53% | 94.73% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 92.53% | 94.45% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 92.49% | 99.17% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.48% | 96.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.61% | 86.33% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 85.14% | 95.50% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 84.51% | 95.56% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 80.75% | 93.56% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
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| There are no matching plants. |
| PubChem | 163068125 |
| LOTUS | LTS0232824 |
| wikiData | Q104944194 |