(5R,7R)-7-[(E)-2-(2,3-dihydro-1H-indol-7-yl)ethenyl]-7-methyl-5-(2-methylprop-1-enyl)-5,6-dihydro-1H-cyclopenta[f]indole
| Internal ID | fdc14dcc-a364-4ab3-a2ea-7a06759bfcdb |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Indoles |
| IUPAC Name | (5R,7R)-7-[(E)-2-(2,3-dihydro-1H-indol-7-yl)ethenyl]-7-methyl-5-(2-methylprop-1-enyl)-5,6-dihydro-1H-cyclopenta[f]indole |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C26H28N2/c1-17(2)13-21-16-26(3,23-15-24-20(9-11-27-24)14-22(21)23)10-7-18-5-4-6-19-8-12-28-25(18)19/h4-7,9-11,13-15,21,27-28H,8,12,16H2,1-3H3/b10-7+/t21-,26-/m0/s1 |
| InChI Key | GKHRETADSMOCEN-CSEYZPLKSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C26H28N2 |
| Molecular Weight | 368.50 g/mol |
| Exact Mass | 368.225248902 g/mol |
| Topological Polar Surface Area (TPSA) | 27.80 Ų |
| XlogP | 7.00 |
| There are no found synonyms. |
![2D Structure of (5R,7R)-7-[(E)-2-(2,3-dihydro-1H-indol-7-yl)ethenyl]-7-methyl-5-(2-methylprop-1-enyl)-5,6-dihydro-1H-cyclopenta[f]indole](https://plantaedb.com/storage/docs/compounds/2023/11/ca8d7360-85f9-11ee-bb4d-05da4bb235e3.jpg "2D Structure of (5R,7R)-7-[(E)-2-(2,3-dihydro-1H-indol-7-yl)ethenyl]-7-methyl-5-(2-methylprop-1-enyl)-5,6-dihydro-1H-cyclopenta[f]indole")
| 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 | 99.31% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.61% | 96.09% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 93.63% | 96.39% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 92.38% | 94.45% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 92.03% | 97.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.24% | 86.33% |
| CHEMBL2581 | P07339 | Cathepsin D | 90.94% | 98.95% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 90.17% | 100.00% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 88.98% | 95.93% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 86.70% | 91.71% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 85.21% | 94.75% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 84.95% | 92.94% |
| CHEMBL1907598 | P05106 | Integrin alpha-V/beta-3 | 84.83% | 95.71% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 84.56% | 85.14% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 84.47% | 93.99% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 84.35% | 97.79% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 82.46% | 93.03% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.39% | 95.89% |
| CHEMBL4145 | Q9UKV0 | Histone deacetylase 9 | 80.45% | 85.49% |
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.
| Raputia megalantha |
| PubChem | 162902426 |
| LOTUS | LTS0136207 |
| wikiData | Q105010008 |