3-[2-(3,4-Dihydroxyphenyl)ethenyl]-7,8-dihydroxypyrano[4,3-b][1]benzofuran-1-one
| Internal ID | 799be164-0cc0-486b-8428-53336dbca901 |
| Taxonomy | Organoheterocyclic compounds > Furopyrans |
| IUPAC Name | 3-[2-(3,4-dihydroxyphenyl)ethenyl]-7,8-dihydroxypyrano[4,3-b][1]benzofuran-1-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H12O7/c20-12-4-2-9(5-13(12)21)1-3-10-6-17-18(19(24)25-10)11-7-14(22)15(23)8-16(11)26-17/h1-8,20-23H |
| InChI Key | RXORBHSDVJWVOW-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C19H12O7 |
| Molecular Weight | 352.30 g/mol |
| Exact Mass | 352.05830272 g/mol |
| Topological Polar Surface Area (TPSA) | 120.00 Ų |
| XlogP | 3.20 |
| There are no found synonyms. |
![2D Structure of 3-[2-(3,4-Dihydroxyphenyl)ethenyl]-7,8-dihydroxypyrano[4,3-b][1]benzofuran-1-one](https://plantaedb.com/storage/docs/compounds/2023/11/3-2-34-dihydroxyphenylethenyl-78-dihydroxypyrano43-b1benzofuran-1-one.jpg "2D Structure of 3-[2-(3,4-Dihydroxyphenyl)ethenyl]-7,8-dihydroxypyrano[4,3-b][1]benzofuran-1-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 | 99.64% | 91.11% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 99.31% | 91.49% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 96.38% | 89.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.35% | 95.56% |
| CHEMBL3194 | P02766 | Transthyretin | 95.13% | 90.71% |
| CHEMBL2085 | P14174 | Macrophage migration inhibitory factor | 87.31% | 80.78% |
| CHEMBL1929 | P47989 | Xanthine dehydrogenase | 84.76% | 96.12% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.28% | 86.33% |
| CHEMBL2581 | P07339 | Cathepsin D | 84.19% | 98.95% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 84.03% | 99.15% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 83.35% | 96.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.76% | 90.71% |
| CHEMBL3788 | O00444 | Serine/threonine-protein kinase PLK4 | 81.53% | 83.65% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 80.41% | 99.23% |
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.
| There are no matching plants. |
| PubChem | 76152600 |
| LOTUS | LTS0131842 |
| wikiData | Q104197039 |