1',4-Dihydroxy-7'-methoxy-2,3'-dimethyl-,(-)-[1,2'-binaphthalene]-5,5',8,8'-tetrone
| Internal ID | e2d51052-46e3-4758-a65a-ca242561d2a1 |
| Taxonomy | Benzenoids > Naphthalenes > Naphthoquinones |
| IUPAC Name | 8-hydroxy-7-(4-hydroxy-2-methyl-5,8-dioxonaphthalen-1-yl)-2-methoxy-6-methylnaphthalene-1,4-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C23H16O7/c1-9-6-11-14(26)8-16(30-3)22(28)19(11)23(29)18(9)17-10(2)7-15(27)20-12(24)4-5-13(25)21(17)20/h4-8,27,29H,1-3H3 |
| InChI Key | BSHDUGNVYJVQMP-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C23H16O7 |
| Molecular Weight | 404.40 g/mol |
| Exact Mass | 404.08960285 g/mol |
| Topological Polar Surface Area (TPSA) | 118.00 Ų |
| XlogP | 3.90 |
| 1',4-Dihydroxy-7'-methoxy-2,3'-dimethyl-,(-)-[1,2'-binaphthalene]-5,5',8,8'-tetrone |
| 119736-96-8 |
![2D Structure of 1',4-Dihydroxy-7'-methoxy-2,3'-dimethyl-,(-)-[1,2'-binaphthalene]-5,5',8,8'-tetrone](https://plantaedb.com/storage/docs/compounds/2023/11/14-dihydroxy-7-methoxy-23-dimethyl-12-binaphthalene-5588-tetrone.jpg "2D Structure of 1',4-Dihydroxy-7'-methoxy-2,3'-dimethyl-,(-)-[1,2'-binaphthalene]-5,5',8,8'-tetrone")
| 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 | 97.68% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.83% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 93.74% | 98.95% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 91.01% | 92.68% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 90.11% | 91.49% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 89.52% | 96.67% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 89.32% | 89.00% |
| CHEMBL2535 | P11166 | Glucose transporter | 88.54% | 98.75% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 88.13% | 86.33% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 87.75% | 96.21% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 87.63% | 85.14% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 87.23% | 94.00% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 86.19% | 99.15% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 86.00% | 93.40% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 85.02% | 90.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 81.02% | 90.71% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 80.84% | 99.23% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 80.29% | 91.07% |
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.
| Diospyros morrisiana |
| PubChem | 14237022 |
| LOTUS | LTS0127541 |
| wikiData | Q81978673 |