(2R)-4-hydroxy-2-(2-hydroxypropan-2-yl)-6-[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one
| Internal ID | d2eea819-a9f2-4296-905e-eee00d00eb7c |
| Taxonomy | Phenylpropanoids and polyketides > Isoflavonoids > Isoflavans > Isoflavanones > 6-prenylated isoflavanones |
| IUPAC Name | (2R)-4-hydroxy-2-(2-hydroxypropan-2-yl)-6-[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C25H26O7/c1-24(2,28)19-8-13-7-12(5-6-16(13)31-19)15-11-30-18-10-17-14(22(26)21(18)23(15)27)9-20(32-17)25(3,4)29/h5-7,10-11,19-20,26,28-29H,8-9H2,1-4H3/t19-,20-/m1/s1 |
| InChI Key | IKQKRLWGUMCUMA-WOJBJXKFSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C25H26O7 |
| Molecular Weight | 438.50 g/mol |
| Exact Mass | 438.16785316 g/mol |
| Topological Polar Surface Area (TPSA) | 105.00 Ų |
| XlogP | 3.40 |
| There are no found synonyms. |
![2D Structure of (2R)-4-hydroxy-2-(2-hydroxypropan-2-yl)-6-[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-one](https://plantaedb.com/storage/docs/compounds/2023/11/62502180-8562-11ee-a602-1157d650714b.jpg "2D Structure of (2R)-4-hydroxy-2-(2-hydroxypropan-2-yl)-6-[(2R)-2-(2-hydroxypropan-2-yl)-2,3-dihydro-1-benzofuran-5-yl]-2,3-dihydrofuro[3,2-g]chromen-5-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 | 98.74% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.39% | 98.95% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 94.08% | 85.14% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 93.35% | 89.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 93.15% | 86.33% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 91.93% | 94.00% |
| CHEMBL5339 | Q5NUL3 | G-protein coupled receptor 120 | 90.77% | 95.78% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 89.73% | 94.73% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 88.92% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.56% | 95.89% |
| CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 86.42% | 85.11% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 85.24% | 89.34% |
| CHEMBL5145 | P15056 | Serine/threonine-protein kinase B-raf | 85.24% | 97.90% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 84.37% | 100.00% |
| CHEMBL4940 | P07195 | L-lactate dehydrogenase B chain | 83.06% | 95.53% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.64% | 90.71% |
| CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 81.57% | 95.71% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 81.35% | 94.45% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.05% | 100.00% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 80.93% | 95.62% |
| CHEMBL2345 | P51812 | Ribosomal protein S6 kinase alpha 3 | 80.30% | 95.64% |
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.
| Ficus microcarpa |
| PubChem | 162949526 |
| LOTUS | LTS0067654 |
| wikiData | Q105382798 |