(3R)-7-hydroxy-alpha-dunnione
| Internal ID | adb5fc41-b38d-4bed-9990-1b85d7feeaba |
| Taxonomy | Organoheterocyclic compounds > Naphthofurans |
| IUPAC Name | (2R)-7-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione |
| SMILES (Canonical) | CC1C(C2=C(O1)C(=O)C3=C(C2=O)C=CC(=C3)O)(C)C |
| SMILES (Isomeric) | C[C@@H]1C(C2=C(O1)C(=O)C3=C(C2=O)C=CC(=C3)O)(C)C |
| InChI | InChI=1S/C15H14O4/c1-7-15(2,3)11-12(17)9-5-4-8(16)6-10(9)13(18)14(11)19-7/h4-7,16H,1-3H3/t7-/m1/s1 |
| InChI Key | QWGVFBHDQGWFGO-SSDOTTSWSA-N |
| Popularity | 1 reference 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 | 2.60 |
| (2R)-7-hydroxy-2,3,3-trimethyl-2H-benzo[f][1]benzofuran-4,9-dione |
| (2R)-7-hydroxy-2,3,3-trimethyl-2H-benzo(f)(1)benzofuran-4,9-dione |
| RefChem:69265 |
| CHEMBL1668322 |
| CHEBI:70156 |
| Q27138497 |
| 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 |
|---|---|---|---|---|
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.33% | 91.49% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.12% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 93.76% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.56% | 91.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 91.65% | 89.00% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 91.27% | 93.40% |
| CHEMBL242 | Q92731 | Estrogen receptor beta | 88.10% | 98.35% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 87.75% | 94.73% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 85.08% | 90.71% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.92% | 99.23% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.77% | 86.33% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 82.50% | 93.56% |
| CHEMBL2553 | Q15418 | Ribosomal protein S6 kinase alpha 1 | 80.12% | 85.11% |
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.
| Streptocarpus dunnii |
| PubChem | 11436816 |
| LOTUS | LTS0082550 |
| wikiData | Q27138497 |