4-Methoxy-5-methyl-6-[4-(1,3,5,8-tetramethyl-7-bicyclo[4.2.0]octa-2,4-dienyl)buta-1,3-dienyl]pyran-2-one
| Internal ID | e1674d07-581e-4285-b44b-9844c60099a5 |
| Taxonomy | Organoheterocyclic compounds > Pyrans > Pyranones and derivatives |
| IUPAC Name | 4-methoxy-5-methyl-6-[4-(1,3,5,8-tetramethyl-7-bicyclo[4.2.0]octa-2,4-dienyl)buta-1,3-dienyl]pyran-2-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C23H28O3/c1-14-11-15(2)22-18(17(4)23(22,5)13-14)9-7-8-10-19-16(3)20(25-6)12-21(24)26-19/h7-13,17-18,22H,1-6H3 |
| InChI Key | AFLXFQMVMOJBCC-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C23H28O3 |
| Molecular Weight | 352.50 g/mol |
| Exact Mass | 352.20384475 g/mol |
| Topological Polar Surface Area (TPSA) | 35.50 Ų |
| XlogP | 4.20 |
| There are no found synonyms. |
![2D Structure of 4-Methoxy-5-methyl-6-[4-(1,3,5,8-tetramethyl-7-bicyclo[4.2.0]octa-2,4-dienyl)buta-1,3-dienyl]pyran-2-one](https://plantaedb.com/storage/docs/compounds/2023/11/5daae700-853b-11ee-ae16-edce7b6ca193.jpg "2D Structure of 4-Methoxy-5-methyl-6-[4-(1,3,5,8-tetramethyl-7-bicyclo[4.2.0]octa-2,4-dienyl)buta-1,3-dienyl]pyran-2-one")
| 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 | 96.28% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.25% | 95.56% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 90.91% | 86.33% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 90.43% | 94.75% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 89.67% | 92.94% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 88.79% | 89.00% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 86.32% | 94.00% |
| CHEMBL2069156 | Q14145 | Kelch-like ECH-associated protein 1 | 86.24% | 82.38% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 86.19% | 96.00% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 85.67% | 85.30% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.73% | 99.23% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 83.20% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 82.12% | 98.95% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 80.74% | 91.07% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 80.66% | 93.40% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 80.09% | 94.45% |
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 | 78121408 |
| LOTUS | LTS0072161 |
| wikiData | Q105094976 |