5-(6,8-dihydrofuro[3,4-g][1,3]benzodioxol-6-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline
| Internal ID | a95a7b83-a21d-482d-bc0c-3c04fedd2c55 |
| Taxonomy | Organoheterocyclic compounds > Tetrahydroisoquinolines |
| IUPAC Name | 5-(6,8-dihydrofuro[3,4-g][1,3]benzodioxol-6-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H19NO5/c1-21-5-4-11-6-16-17(25-9-24-16)7-13(11)18(21)20-12-2-3-15-19(26-10-23-15)14(12)8-22-20/h2-3,6-7,18,20H,4-5,8-10H2,1H3 |
| InChI Key | AACMFFIUYXGCOC-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C20H19NO5 |
| Molecular Weight | 353.40 g/mol |
| Exact Mass | 353.12632271 g/mol |
| Topological Polar Surface Area (TPSA) | 49.40 Ų |
| XlogP | 2.40 |
| There are no found synonyms. |
![2D Structure of 5-(6,8-dihydrofuro[3,4-g][1,3]benzodioxol-6-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline](https://plantaedb.com/storage/docs/compounds/2023/11/205c7f70-83c9-11ee-8742-692c1b9f25fa.jpg "2D Structure of 5-(6,8-dihydrofuro[3,4-g][1,3]benzodioxol-6-yl)-6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinoline")
| 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 |
|---|---|---|---|---|
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 98.54% | 93.40% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 96.64% | 96.77% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.54% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.44% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 92.72% | 98.95% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 89.00% | 86.33% |
| CHEMBL3227 | P41594 | Metabotropic glutamate receptor 5 | 88.22% | 96.42% |
| CHEMBL2146302 | O94925 | Glutaminase kidney isoform, mitochondrial | 88.21% | 100.00% |
| CHEMBL1841 | P06241 | Tyrosine-protein kinase FYN | 87.42% | 81.29% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 86.14% | 100.00% |
| CHEMBL2073 | P07947 | Tyrosine-protein kinase YES | 85.90% | 83.14% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 85.81% | 93.99% |
| CHEMBL240 | Q12809 | HERG | 85.54% | 89.76% |
| CHEMBL5311 | P37023 | Serine/threonine-protein kinase receptor R3 | 85.41% | 82.67% |
| CHEMBL2335 | P42785 | Lysosomal Pro-X carboxypeptidase | 85.38% | 100.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 84.74% | 94.45% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 83.97% | 91.11% |
| CHEMBL2056 | P21728 | Dopamine D1 receptor | 83.45% | 91.00% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 83.38% | 97.25% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 81.81% | 92.62% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 81.46% | 91.49% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.09% | 95.89% |
| CHEMBL4895 | P30530 | Tyrosine-protein kinase receptor UFO | 80.96% | 90.95% |
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.
| Corydalis gortschakovii |
| PubChem | 162898197 |
| LOTUS | LTS0073661 |
| wikiData | Q104907826 |