(3R,5R,6E,10R)-3,7,11-trimethyldodeca-1,6,11-triene-3,5,10-triol
| Internal ID | 1b5bb08d-aae2-4558-af3d-dbe5f3d02569 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids |
| IUPAC Name | (3R,5R,6E,10R)-3,7,11-trimethyldodeca-1,6,11-triene-3,5,10-triol |
| SMILES (Canonical) | CC(=C)C(CCC(=CC(CC(C)(C=C)O)O)C)O |
| SMILES (Isomeric) | CC(=C)[C@@H](CC/C(=C/[C@@H](C[C@](C)(C=C)O)O)/C)O |
| InChI | InChI=1S/C15H26O3/c1-6-15(5,18)10-13(16)9-12(4)7-8-14(17)11(2)3/h6,9,13-14,16-18H,1-2,7-8,10H2,3-5H3/b12-9+/t13-,14+,15-/m0/s1 |
| InChI Key | UUUBEBQXNXKPPJ-WQXAFCNFSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H26O3 |
| Molecular Weight | 254.36 g/mol |
| Exact Mass | 254.18819469 g/mol |
| Topological Polar Surface Area (TPSA) | 60.70 Ų |
| XlogP | 2.50 |
| There are no found synonyms. |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 93.47% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 90.54% | 96.09% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 90.31% | 94.73% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 89.90% | 97.25% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 88.22% | 99.17% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 88.14% | 90.93% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 85.96% | 92.68% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 83.85% | 85.14% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 83.65% | 97.29% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 83.21% | 97.21% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 82.89% | 96.47% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 82.29% | 95.89% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 81.21% | 96.95% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 80.29% | 92.29% |
| CHEMBL233 | P35372 | Mu opioid receptor | 80.09% | 97.93% |
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.
| Geigeria ornativa |
| PubChem | 162965161 |
| LOTUS | LTS0203690 |
| wikiData | Q105279591 |