5-hydroxy-4-(hydroxymethyl)-9,10-dimethoxy-1H-naphtho[3,2-e][2]benzofuran-3,6,11-trione
| Internal ID | 4fef68f4-1630-41a7-9f76-5c5e19414d17 |
| Taxonomy | Benzenoids > Anthracenes > Anthraquinones |
| IUPAC Name | 5-hydroxy-4-(hydroxymethyl)-9,10-dimethoxy-1H-naphtho[3,2-e][2]benzofuran-3,6,11-trione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H14O8/c1-25-10-4-3-7-13(18(10)26-2)17(23)12-9-6-27-19(24)11(9)8(5-20)16(22)14(12)15(7)21/h3-4,20,22H,5-6H2,1-2H3 |
| InChI Key | LXLDREVYTBJZLB-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C19H14O8 |
| Molecular Weight | 370.30 g/mol |
| Exact Mass | 370.06886740 g/mol |
| Topological Polar Surface Area (TPSA) | 119.00 Ų |
| XlogP | 1.50 |
| There are no found synonyms. |
![2D Structure of 5-hydroxy-4-(hydroxymethyl)-9,10-dimethoxy-1H-naphtho[3,2-e][2]benzofuran-3,6,11-trione](https://plantaedb.com/storage/docs/compounds/2023/11/5-hydroxy-4-hydroxymethyl-910-dimethoxy-1h-naphtho32-e2benzofuran-3611-trione.jpg "2D Structure of 5-hydroxy-4-(hydroxymethyl)-9,10-dimethoxy-1H-naphtho[3,2-e][2]benzofuran-3,6,11-trione")
| 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 |
|---|---|---|---|---|
| CHEMBL2002 | P12268 | Inosine-5'-monophosphate dehydrogenase 2 | 98.49% | 98.21% |
| CHEMBL2581 | P07339 | Cathepsin D | 96.58% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.31% | 91.11% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.73% | 95.56% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.23% | 86.33% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 90.55% | 89.00% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 89.49% | 94.00% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 88.33% | 96.09% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 84.89% | 96.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 84.53% | 99.23% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 83.57% | 90.20% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 83.31% | 90.00% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 83.09% | 91.49% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 82.60% | 96.67% |
| CHEMBL2535 | P11166 | Glucose transporter | 82.41% | 98.75% |
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.
| Berchemia discolor |
| PubChem | 14704556 |
| LOTUS | LTS0221002 |
| wikiData | Q105158917 |