(E,2E,4E)-8-bromo-6,7-dichloro-3,7-dimethyl-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]octa-2,4-dien-1-imine
| Internal ID | 846e66df-589f-4de3-b3e3-4723c6f6d67f |
| Taxonomy | Benzenoids > Benzene and substituted derivatives > Halobenzenes > Fluorobenzenes |
| IUPAC Name | (E,2E,4E)-8-bromo-6,7-dichloro-3,7-dimethyl-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]octa-2,4-dien-1-imine |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C17H15BrCl2F5NO/c1-9(3-4-11(19)17(2,20)8-18)5-6-26-27-7-10-12(21)14(23)16(25)15(24)13(10)22/h3-6,11H,7-8H2,1-2H3/b4-3+,9-5+,26-6+ |
| InChI Key | MLESYUWZFTYAKV-SOTNQFBPSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C17H15BrCl2F5NO |
| Molecular Weight | 495.10 g/mol |
| Exact Mass | 492.96342 g/mol |
| Topological Polar Surface Area (TPSA) | 21.60 Ų |
| XlogP | 6.10 |
| There are no found synonyms. |
![2D Structure of (E,2E,4E)-8-bromo-6,7-dichloro-3,7-dimethyl-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]octa-2,4-dien-1-imine](https://plantaedb.com/storage/docs/compounds/2023/11/44173470-8499-11ee-a131-61494382903d.jpg "2D Structure of (E,2E,4E)-8-bromo-6,7-dichloro-3,7-dimethyl-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]octa-2,4-dien-1-imine")
| 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 | 88.43% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.82% | 96.09% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 87.65% | 98.75% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 87.42% | 93.31% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 87.42% | 89.34% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 86.99% | 99.17% |
| CHEMBL242 | Q92731 | Estrogen receptor beta | 86.64% | 98.35% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.38% | 86.33% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 85.82% | 96.95% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 85.21% | 97.21% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.08% | 94.73% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 85.04% | 85.94% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 84.68% | 97.25% |
| CHEMBL2581 | P07339 | Cathepsin D | 84.66% | 98.95% |
| CHEMBL1966 | Q02127 | Dihydroorotate dehydrogenase | 83.27% | 96.09% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 81.64% | 94.45% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 80.42% | 95.50% |
| CHEMBL4015 | P41597 | C-C chemokine receptor type 2 | 80.26% | 98.57% |
| CHEMBL4581 | P52732 | Kinesin-like protein 1 | 80.03% | 93.18% |
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 | 16215166 |
| LOTUS | LTS0169755 |
| wikiData | Q103818223 |