9b-Hydroxy-2-(2-hydroxypropan-2-yl)-4,8-dimethyl-1,2-dihydrofuro[3,2-f]isoquinolin-5-one
| Internal ID | 03be9411-d6c5-4f2e-858f-97c23532e8f6 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbonyl compounds > Aryl ketones |
| IUPAC Name | 9b-hydroxy-2-(2-hydroxypropan-2-yl)-4,8-dimethyl-1,2-dihydrofuro[3,2-f]isoquinolin-5-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C16H19NO4/c1-8-5-11-10(7-17-8)13(18)9(2)14-16(11,20)6-12(21-14)15(3,4)19/h5,7,12,19-20H,6H2,1-4H3 |
| InChI Key | XKFSBTUQCGMWKU-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C16H19NO4 |
| Molecular Weight | 289.33 g/mol |
| Exact Mass | 289.13140809 g/mol |
| Topological Polar Surface Area (TPSA) | 79.70 Ų |
| XlogP | 0.50 |
| There are no found synonyms. |
![2D Structure of 9b-Hydroxy-2-(2-hydroxypropan-2-yl)-4,8-dimethyl-1,2-dihydrofuro[3,2-f]isoquinolin-5-one](https://plantaedb.com/storage/docs/compounds/2023/11/9b-hydroxy-2-2-hydroxypropan-2-yl-48-dimethyl-12-dihydrofuro32-fisoquinolin-5-one.jpg "2D Structure of 9b-Hydroxy-2-(2-hydroxypropan-2-yl)-4,8-dimethyl-1,2-dihydrofuro[3,2-f]isoquinolin-5-one")
| 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 |
|---|---|---|---|---|
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 98.27% | 85.14% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.38% | 91.49% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 91.15% | 94.00% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 91.05% | 89.00% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 90.57% | 89.63% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.72% | 95.56% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.46% | 99.23% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 86.62% | 94.75% |
| CHEMBL5409 | Q8TDU6 | G-protein coupled bile acid receptor 1 | 85.98% | 93.65% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.55% | 86.33% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 84.17% | 94.73% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 82.59% | 96.90% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 82.50% | 96.09% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 82.20% | 100.00% |
| CHEMBL2581 | P07339 | Cathepsin D | 81.44% | 98.95% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 81.41% | 97.25% |
| CHEMBL2535 | P11166 | Glucose transporter | 80.84% | 98.75% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.45% | 95.89% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 162951390 |
| LOTUS | LTS0114976 |
| wikiData | Q104201067 |