9-Hydroxy-10-(1-hydroxyhexa-2,4-dienylidene)-3,7,9-trimethyl-3-azatricyclo[5.2.2.02,6]undecane-4,8,11-trione
| Internal ID | 37cc2a86-5cf1-4b95-bf76-7913121494c3 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives |
| IUPAC Name | 9-hydroxy-10-(1-hydroxyhexa-2,4-dienylidene)-3,7,9-trimethyl-3-azatricyclo[5.2.2.02,6]undecane-4,8,11-trione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H23NO5/c1-5-6-7-8-11(21)13-14-15-10(9-12(22)20(15)4)18(2,16(13)23)17(24)19(14,3)25/h5-8,10,14-15,21,25H,9H2,1-4H3 |
| InChI Key | MENBYVFGLMZQHZ-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C19H23NO5 |
| Molecular Weight | 345.40 g/mol |
| Exact Mass | 345.15762283 g/mol |
| Topological Polar Surface Area (TPSA) | 94.90 Ų |
| XlogP | 1.20 |
| There are no found synonyms. |
![2D Structure of 9-Hydroxy-10-(1-hydroxyhexa-2,4-dienylidene)-3,7,9-trimethyl-3-azatricyclo[5.2.2.02,6]undecane-4,8,11-trione](https://plantaedb.com/storage/docs/compounds/2023/11/8c18d160-8631-11ee-a581-a7ec014d9991.jpg "2D Structure of 9-Hydroxy-10-(1-hydroxyhexa-2,4-dienylidene)-3,7,9-trimethyl-3-azatricyclo[5.2.2.02,6]undecane-4,8,11-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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.54% | 96.09% |
| CHEMBL284 | P27487 | Dipeptidyl peptidase IV | 94.51% | 95.69% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 93.75% | 94.75% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 93.55% | 83.82% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 93.05% | 85.14% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 92.91% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.60% | 98.95% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 87.67% | 90.17% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.61% | 94.45% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 87.40% | 86.33% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 84.37% | 93.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 81.79% | 91.11% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.59% | 99.23% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.00% | 95.89% |
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.
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| There are no matching plants. |
| PubChem | 162998310 |
| LOTUS | LTS0085670 |
| wikiData | Q104171612 |