3-(1H-indol-3-yl)-1,4-dimethoxy-5a,6-dihydro-[1]benzofuro[2,3-b]indole-2,10b-diol
| Internal ID | 46646c39-ea85-43c6-8e64-47b0c8b93bda |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Indoles |
| IUPAC Name | 3-(1H-indol-3-yl)-1,4-dimethoxy-5a,6-dihydro-[1]benzofuro[2,3-b]indole-2,10b-diol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H20N2O5/c1-29-20-17(13-11-25-15-9-5-3-7-12(13)15)19(27)21(30-2)18-22(20)31-23-24(18,28)14-8-4-6-10-16(14)26-23/h3-11,23,25-28H,1-2H3 |
| InChI Key | BNNQNJBXFAFMOE-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C24H20N2O5 |
| Molecular Weight | 416.40 g/mol |
| Exact Mass | 416.13722174 g/mol |
| Topological Polar Surface Area (TPSA) | 96.00 Ų |
| XlogP | 3.60 |
| There are no found synonyms. |
![2D Structure of 3-(1H-indol-3-yl)-1,4-dimethoxy-5a,6-dihydro-[1]benzofuro[2,3-b]indole-2,10b-diol](https://plantaedb.com/storage/docs/compounds/2023/11/3-1h-indol-3-yl-14-dimethoxy-5a6-dihydro-1benzofuro23-bindole-210b-diol.jpg "2D Structure of 3-(1H-indol-3-yl)-1,4-dimethoxy-5a,6-dihydro-[1]benzofuro[2,3-b]indole-2,10b-diol")
| 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 | 99.49% | 91.11% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 94.12% | 96.39% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.67% | 96.09% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 92.60% | 94.00% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 90.57% | 89.00% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 89.01% | 94.62% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.58% | 99.23% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 88.09% | 95.56% |
| CHEMBL1821 | P08173 | Muscarinic acetylcholine receptor M4 | 87.94% | 94.08% |
| CHEMBL2708 | Q16584 | Mitogen-activated protein kinase kinase kinase 11 | 86.28% | 81.14% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 85.73% | 94.45% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 85.60% | 88.56% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.44% | 85.14% |
| CHEMBL2002 | P12268 | Inosine-5'-monophosphate dehydrogenase 2 | 85.37% | 98.21% |
| CHEMBL3830 | Q2M2I8 | Adaptor-associated kinase | 85.16% | 83.10% |
| CHEMBL2716 | Q8WUI4 | Histone deacetylase 7 | 84.84% | 89.44% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 84.41% | 99.15% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 84.06% | 92.62% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 83.89% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.68% | 95.89% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 81.49% | 86.33% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 81.05% | 91.49% |
| CHEMBL2095172 | P14867 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 80.30% | 92.67% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 163013709 |
| LOTUS | LTS0076035 |
| wikiData | Q104938921 |