8-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione
| Internal ID | 3739a863-639d-43e5-9668-fd63c0206b4c |
| Taxonomy | Organoheterocyclic compounds > Naphthofurans |
| IUPAC Name | 8-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C15H14O4/c1-7-15(2,3)11-12(17)8-5-4-6-9(16)10(8)13(18)14(11)19-7/h4-7,16H,1-3H3 |
| InChI Key | NRKXQJFKICRHKM-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H14O4 |
| Molecular Weight | 258.27 g/mol |
| Exact Mass | 258.08920892 g/mol |
| Topological Polar Surface Area (TPSA) | 63.60 Ų |
| XlogP | 3.20 |
| There are no found synonyms. |
![2D Structure of 8-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione](https://plantaedb.com/storage/docs/compounds/2023/11/8-hydroxy-233-trimethyl-2h-benzof1benzofuran-49-dione.jpg "2D Structure of 8-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione")
| 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 |
|---|---|---|---|---|
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.58% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 96.45% | 98.95% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.87% | 91.49% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 95.35% | 99.23% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.34% | 91.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 90.91% | 89.00% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 90.40% | 93.40% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 89.65% | 94.73% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 89.50% | 94.75% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 88.01% | 96.38% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 87.30% | 93.03% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 87.30% | 99.15% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 81.94% | 86.33% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 81.87% | 94.00% |
| CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 80.48% | 85.11% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 80.47% | 93.56% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 80.44% | 82.69% |
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 | 72770869 |
| LOTUS | LTS0070525 |
| wikiData | Q105184631 |