(1S,2R,7S,9R)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane
| Internal ID | 0b1e18b0-a2e4-4831-bbec-256a3a75349e |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids |
| IUPAC Name | (1S,2R,7S,9R)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane |
| SMILES (Canonical) | CC1(CCCC2(C3C1C(C2=C)CC3)C)C |
| SMILES (Isomeric) | C[C@]12CCCC([C@H]3[C@@H]1CC[C@H]3C2=C)(C)C |
| InChI | InChI=1S/C15H24/c1-10-11-6-7-12-13(11)14(2,3)8-5-9-15(10,12)4/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+,15+/m0/s1 |
| InChI Key | PDSNLYSELAIEBU-RMRHIDDWSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H24 |
| Molecular Weight | 204.35 g/mol |
| Exact Mass | 204.187800766 g/mol |
| Topological Polar Surface Area (TPSA) | 0.00 Ų |
| XlogP | 5.10 |
| There are no found synonyms. |
![2D Structure of (1S,2R,7S,9R)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane](https://plantaedb.com/storage/docs/compounds/2023/11/1s2r7s9r-337-trimethyl-8-methylidenetricyclo540029undecane.jpg "2D Structure of (1S,2R,7S,9R)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane")
| 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 | 93.78% | 97.25% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.84% | 91.11% |
| CHEMBL4370 | P16662 | UDP-glucuronosyltransferase 2B7 | 89.81% | 100.00% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 88.00% | 97.09% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.57% | 96.09% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.50% | 95.89% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 85.10% | 100.00% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 84.15% | 99.18% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 84.06% | 92.94% |
| CHEMBL238 | Q01959 | Dopamine transporter | 83.97% | 95.88% |
| CHEMBL233 | P35372 | Mu opioid receptor | 83.63% | 97.93% |
| CHEMBL237 | P41145 | Kappa opioid receptor | 82.57% | 98.10% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 82.53% | 95.50% |
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.
To see more specific details click the taxa you are interested in.
| Cedrus libani |
| Herbertus dicranus |
| Juniperus rigida var. conferta |
| Lippia chevalierii |
| Marsupella emarginata |
| Pinus thunbergii |
| PubChem | 12304749 |
| LOTUS | LTS0211250 |
| wikiData | Q105206747 |