(1R,3S,5R,8S,10S,13R)-1,6,6,10-tetramethyl-4,9,14-trioxatetracyclo[11.1.0.03,5.08,10]tetradecane
| Internal ID | 9c481dce-331c-4283-92e8-6a757414c279 |
| Taxonomy | Organoheterocyclic compounds > Epoxides |
| IUPAC Name | (1R,3S,5R,8S,10S,13R)-1,6,6,10-tetramethyl-4,9,14-trioxatetracyclo[11.1.0.03,5.08,10]tetradecane |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C15H24O3/c1-13(2)8-11-14(3,18-11)6-5-10-15(4,17-10)7-9-12(13)16-9/h9-12H,5-8H2,1-4H3/t9-,10+,11-,12-,14-,15+/m0/s1 |
| InChI Key | DKHWLZDWNCVYPO-FIPALRBNSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C15H24O3 |
| Molecular Weight | 252.35 g/mol |
| Exact Mass | 252.17254462 g/mol |
| Topological Polar Surface Area (TPSA) | 37.60 Ų |
| XlogP | 2.30 |
| There are no found synonyms. |
![2D Structure of (1R,3S,5R,8S,10S,13R)-1,6,6,10-tetramethyl-4,9,14-trioxatetracyclo[11.1.0.03,5.08,10]tetradecane](https://plantaedb.com/storage/docs/compounds/2023/11/1r3s5r8s10s13r-16610-tetramethyl-4914-trioxatetracyclo11100350810tetradecane.jpg "2D Structure of (1R,3S,5R,8S,10S,13R)-1,6,6,10-tetramethyl-4,9,14-trioxatetracyclo[11.1.0.03,5.08,10]tetradecane")
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.32% | 96.09% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 90.78% | 96.61% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 89.12% | 97.25% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 85.73% | 97.09% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 84.18% | 97.14% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 83.56% | 85.14% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 83.44% | 93.40% |
| CHEMBL259 | P32245 | Melanocortin receptor 4 | 82.31% | 95.38% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.60% | 100.00% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 81.47% | 95.50% |
| CHEMBL1907601 | P11802 | Cyclin-dependent kinase 4/cyclin D1 | 81.17% | 98.99% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 80.83% | 93.04% |
| CHEMBL240 | Q12809 | HERG | 80.78% | 89.76% |
| CHEMBL3746 | P80365 | 11-beta-hydroxysteroid dehydrogenase 2 | 80.53% | 94.78% |
| CHEMBL237 | P41145 | Kappa opioid receptor | 80.18% | 98.10% |
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.
| Cyperus longus |
| PubChem | 163190209 |
| LOTUS | LTS0136630 |
| wikiData | Q104983298 |