(10S)-3,4,17-trimethoxy-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-5,16-diol
| Internal ID | d97ea2d1-f743-40d0-810f-b9745d19b64f |
| Taxonomy | Alkaloids and derivatives > Homoaporphines |
| IUPAC Name | (10S)-3,4,17-trimethoxy-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-5,16-diol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H23NO5/c1-24-18-13(22)9-11-6-7-21-12-5-4-10-8-14(23)19(25-2)20(26-3)16(10)17(18)15(11)12/h8-9,12,21-23H,4-7H2,1-3H3/t12-/m0/s1 |
| InChI Key | QOKTUZPLWRGZSC-LBPRGKRZSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C20H23NO5 |
| Molecular Weight | 357.40 g/mol |
| Exact Mass | 357.15762283 g/mol |
| Topological Polar Surface Area (TPSA) | 80.20 Ų |
| XlogP | 2.60 |
| There are no found synonyms. |
![2D Structure of (10S)-3,4,17-trimethoxy-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-5,16-diol](https://plantaedb.com/storage/docs/compounds/2023/11/ec983480-858a-11ee-a302-43108a43f936.jpg "2D Structure of (10S)-3,4,17-trimethoxy-11-azatetracyclo[8.7.1.02,7.014,18]octadeca-1(18),2,4,6,14,16-hexaene-5,16-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 | 99.01% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.11% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 95.23% | 97.09% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 94.58% | 93.99% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 94.14% | 91.79% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 91.80% | 92.94% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 91.41% | 94.45% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 90.03% | 95.62% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 89.24% | 94.75% |
| CHEMBL213 | P08588 | Beta-1 adrenergic receptor | 88.82% | 95.56% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.34% | 95.89% |
| CHEMBL5469 | Q14289 | Protein tyrosine kinase 2 beta | 86.05% | 91.03% |
| CHEMBL2581 | P07339 | Cathepsin D | 84.56% | 98.95% |
| CHEMBL2535 | P11166 | Glucose transporter | 83.81% | 98.75% |
| CHEMBL215 | P09917 | Arachidonate 5-lipoxygenase | 82.65% | 92.68% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 81.75% | 99.15% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 80.77% | 100.00% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 80.63% | 91.49% |
| CHEMBL3438 | Q05513 | Protein kinase C zeta | 80.00% | 88.48% |
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.
| There are no matching plants. |
| PubChem | 14488024 |
| LOTUS | LTS0122109 |
| wikiData | Q105224951 |