4-Bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-8-en-10-ol
| Internal ID | 1b05172c-ea48-42c1-a621-bdaf6f58837b |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Chamigranes |
| IUPAC Name | 4-bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-8-en-10-ol |
| SMILES (Canonical) | CC1=CCC2(CC1O)C(=C)CCC(C2(C)C)Br |
| SMILES (Isomeric) | CC1=CCC2(CC1O)C(=C)CCC(C2(C)C)Br |
| InChI | InChI=1S/C15H23BrO/c1-10-7-8-15(9-12(10)17)11(2)5-6-13(16)14(15,3)4/h7,12-13,17H,2,5-6,8-9H2,1,3-4H3 |
| InChI Key | RYEOAMGBDUNXFU-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H23BrO |
| Molecular Weight | 299.25 g/mol |
| Exact Mass | 298.09323 g/mol |
| Topological Polar Surface Area (TPSA) | 20.20 Ų |
| XlogP | 3.50 |
| There are no found synonyms. |
![2D Structure of 4-Bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-8-en-10-ol](https://plantaedb.com/storage/docs/compounds/2023/11/4-bromo-559-trimethyl-1-methylidenespiro55undec-8-en-10-ol.jpg "2D Structure of 4-Bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-8-en-10-ol")
| 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 | 91.64% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 90.31% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.66% | 95.56% |
| CHEMBL1871 | P10275 | Androgen Receptor | 89.44% | 96.43% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 89.22% | 100.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 84.74% | 95.89% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 83.39% | 93.03% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 83.24% | 97.25% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.22% | 97.09% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 83.20% | 95.89% |
| CHEMBL2581 | P07339 | Cathepsin D | 81.98% | 98.95% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 81.98% | 90.17% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 80.89% | 92.94% |
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 | 76548709 |
| LOTUS | LTS0239408 |
| wikiData | Q105247515 |