5-[6-Hydroxy-7-(3-methylbut-2-enyl)-1-benzofuran-2-yl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol
| Internal ID | 905e97ac-1146-4a72-b219-58d134e95688 |
| Taxonomy | Phenylpropanoids and polyketides > 2-arylbenzofuran flavonoids |
| IUPAC Name | 5-[6-hydroxy-7-(3-methylbut-2-enyl)-1-benzofuran-2-yl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C29H34O4/c1-17(2)7-11-21-25(31)16-26(32)22(12-8-18(3)4)28(21)27-15-20-10-14-24(30)23(29(20)33-27)13-9-19(5)6/h7-10,14-16,30-32H,11-13H2,1-6H3 |
| InChI Key | SCYFWIZEROMNMU-UHFFFAOYSA-N |
| Popularity | 5 references in papers |
| Molecular Formula | C29H34O4 |
| Molecular Weight | 446.60 g/mol |
| Exact Mass | 446.24570956 g/mol |
| Topological Polar Surface Area (TPSA) | 73.80 Ų |
| XlogP | 8.70 |
| There are no found synonyms. |
![2D Structure of 5-[6-Hydroxy-7-(3-methylbut-2-enyl)-1-benzofuran-2-yl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol](https://plantaedb.com/storage/docs/compounds/2023/11/5-6-hydroxy-7-3-methylbut-2-enyl-1-benzofuran-2-yl-46-bis3-methylbut-2-enylbenzene-13-diol.jpg "2D Structure of 5-[6-Hydroxy-7-(3-methylbut-2-enyl)-1-benzofuran-2-yl]-4,6-bis(3-methylbut-2-enyl)benzene-1,3-diol")
| 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 | 98.98% | 91.11% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 94.98% | 94.73% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 90.39% | 96.95% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 89.77% | 99.15% |
| CHEMBL2581 | P07339 | Cathepsin D | 88.09% | 98.95% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.23% | 94.45% |
| CHEMBL3038469 | P24941 | CDK2/Cyclin A | 85.85% | 91.38% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.74% | 86.33% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 83.48% | 90.00% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 83.22% | 85.30% |
| CHEMBL3492 | P49721 | Proteasome Macropain subunit | 81.96% | 90.24% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 81.81% | 97.21% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 81.23% | 99.17% |
| CHEMBL1163101 | O75460 | Serine/threonine-protein kinase/endoribonuclease IRE1 | 80.92% | 98.11% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 80.72% | 91.49% |
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.
| Artocarpus lacucha |
| Artocarpus tonkinensis |
| PubChem | 10253008 |
| LOTUS | LTS0136117 |
| wikiData | Q105250495 |