3-[2-[(1R,6R)-1,2,6-trimethylcyclohex-2-en-1-yl]ethyl]furan
| Internal ID | 4d3fe8b1-0fa4-4f1c-a37e-9614201e040c |
| Taxonomy | Organoheterocyclic compounds > Heteroaromatic compounds |
| IUPAC Name | 3-[2-[(1R,6R)-1,2,6-trimethylcyclohex-2-en-1-yl]ethyl]furan |
| SMILES (Canonical) | CC1CCC=C(C1(C)CCC2=COC=C2)C |
| SMILES (Isomeric) | C[C@@H]1CCC=C([C@]1(C)CCC2=COC=C2)C |
| InChI | InChI=1S/C15H22O/c1-12-5-4-6-13(2)15(12,3)9-7-14-8-10-16-11-14/h5,8,10-11,13H,4,6-7,9H2,1-3H3/t13-,15+/m1/s1 |
| InChI Key | AIKFIBDPVFKLSI-HIFRSBDPSA-N |
| Popularity | 1 reference in papers |
| Molecular Formula | C15H22O |
| Molecular Weight | 218.33 g/mol |
| Exact Mass | 218.167065321 g/mol |
| Topological Polar Surface Area (TPSA) | 13.10 Ų |
| XlogP | 4.50 |
| There are no found synonyms. |
![2D Structure of 3-[2-[(1R,6R)-1,2,6-trimethylcyclohex-2-en-1-yl]ethyl]furan](https://plantaedb.com/storage/docs/compounds/2023/11/3-2-1r6r-126-trimethylcyclohex-2-en-1-ylethylfuran.jpg "2D Structure of 3-[2-[(1R,6R)-1,2,6-trimethylcyclohex-2-en-1-yl]ethyl]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 |
|---|---|---|---|---|
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 97.11% | 97.25% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.87% | 97.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 88.88% | 98.95% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.68% | 86.33% |
| CHEMBL4481 | P35228 | Nitric oxide synthase, inducible | 86.45% | 94.80% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.44% | 95.89% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 86.10% | 96.09% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 84.88% | 90.17% |
| CHEMBL4072 | P07858 | Cathepsin B | 84.78% | 93.67% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 84.16% | 86.00% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 81.62% | 97.79% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 81.56% | 91.11% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 80.30% | 93.31% |
| CHEMBL264 | Q9Y5N1 | Histamine H3 receptor | 80.12% | 91.43% |
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 | 11769943 |
| LOTUS | LTS0085573 |
| wikiData | Q104912831 |