3-[6-(2,2-Dimethyl-6-methylidenecyclohexyl)-4-methylhex-3-enyl]furan
| Internal ID | 4b8eed1e-f70e-4c39-bdfd-6ded52437a4b |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids |
| IUPAC Name | 3-[6-(2,2-dimethyl-6-methylidenecyclohexyl)-4-methylhex-3-enyl]furan |
| SMILES (Canonical) | CC(=CCCC1=COC=C1)CCC2C(=C)CCCC2(C)C |
| SMILES (Isomeric) | CC(=CCCC1=COC=C1)CCC2C(=C)CCCC2(C)C |
| InChI | InChI=1S/C20H30O/c1-16(7-5-9-18-12-14-21-15-18)10-11-19-17(2)8-6-13-20(19,3)4/h7,12,14-15,19H,2,5-6,8-11,13H2,1,3-4H3 |
| InChI Key | KBXKFFRFDVAEGH-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C20H30O |
| Molecular Weight | 286.50 g/mol |
| Exact Mass | 286.229665576 g/mol |
| Topological Polar Surface Area (TPSA) | 13.10 Ų |
| XlogP | 6.50 |
| There are no found synonyms. |
![2D Structure of 3-[6-(2,2-Dimethyl-6-methylidenecyclohexyl)-4-methylhex-3-enyl]furan](https://plantaedb.com/storage/docs/compounds/2023/11/3-6-22-dimethyl-6-methylidenecyclohexyl-4-methylhex-3-enylfuran.jpg "2D Structure of 3-[6-(2,2-Dimethyl-6-methylidenecyclohexyl)-4-methylhex-3-enyl]furan")
| 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 | 97.91% | 91.11% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 96.51% | 97.25% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 95.60% | 94.45% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 94.47% | 83.82% |
| CHEMBL2039 | P27338 | Monoamine oxidase B | 93.31% | 92.51% |
| CHEMBL233 | P35372 | Mu opioid receptor | 88.28% | 97.93% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.15% | 96.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.99% | 86.33% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.47% | 94.73% |
| CHEMBL2581 | P07339 | Cathepsin D | 84.68% | 98.95% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.48% | 95.89% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.09% | 97.09% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 82.84% | 92.62% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 81.71% | 91.49% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.34% | 100.00% |
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 | 72726849 |
| LOTUS | LTS0228398 |
| wikiData | Q105138587 |