2-Methoxy-9,9,16,16-tetramethyl-8-oxa-14,24,26-triazaheptacyclo[18.5.2.01,17.03,15.04,13.07,12.020,24]heptacosa-3(15),4(13),5,7(12),10-pentaene-25,27-dione
| Internal ID | ce3f05b1-ce50-4f1f-8dfa-f93586de24cd |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Carbazoles |
| IUPAC Name | 2-methoxy-9,9,16,16-tetramethyl-8-oxa-14,24,26-triazaheptacyclo[18.5.2.01,17.03,15.04,13.07,12.020,24]heptacosa-3(15),4(13),5,7(12),10-pentaene-25,27-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C28H33N3O4/c1-25(2)12-9-15-17(35-25)8-7-16-19-21(29-20(15)16)26(3,4)18-10-13-27-11-6-14-31(27)24(33)28(18,22(19)34-5)30-23(27)32/h7-9,12,18,22,29H,6,10-11,13-14H2,1-5H3,(H,30,32) |
| InChI Key | ZGYRLHKDVICOHD-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C28H33N3O4 |
| Molecular Weight | 475.60 g/mol |
| Exact Mass | 475.24710654 g/mol |
| Topological Polar Surface Area (TPSA) | 83.70 Ų |
| XlogP | 3.20 |
| There are no found synonyms. |
![2D Structure of 2-Methoxy-9,9,16,16-tetramethyl-8-oxa-14,24,26-triazaheptacyclo[18.5.2.01,17.03,15.04,13.07,12.020,24]heptacosa-3(15),4(13),5,7(12),10-pentaene-25,27-dione](https://plantaedb.com/storage/docs/compounds/2023/11/38f1ed60-8339-11ee-8bf0-53a33a9c4255.jpg "2D Structure of 2-Methoxy-9,9,16,16-tetramethyl-8-oxa-14,24,26-triazaheptacyclo[18.5.2.01,17.03,15.04,13.07,12.020,24]heptacosa-3(15),4(13),5,7(12),10-pentaene-25,27-dione")
| 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 |
|---|---|---|---|---|
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 99.07% | 94.45% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.57% | 98.95% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 96.53% | 93.40% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 96.51% | 96.77% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.18% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.90% | 91.11% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 94.04% | 93.99% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 93.91% | 94.75% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.32% | 97.09% |
| CHEMBL4835 | P00338 | L-lactate dehydrogenase A chain | 90.78% | 95.34% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 90.51% | 93.04% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.45% | 95.89% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.43% | 95.56% |
| CHEMBL3922 | P50579 | Methionine aminopeptidase 2 | 89.02% | 97.28% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 88.44% | 94.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.23% | 99.23% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 88.10% | 90.08% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 87.06% | 89.00% |
| CHEMBL4225 | P49760 | Dual specificity protein kinase CLK2 | 86.43% | 80.96% |
| CHEMBL4895 | P30530 | Tyrosine-protein kinase receptor UFO | 85.62% | 90.95% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 84.99% | 97.25% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 84.70% | 92.88% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 84.27% | 98.59% |
| CHEMBL4481 | P35228 | Nitric oxide synthase, inducible | 83.96% | 94.80% |
| CHEMBL2781 | P19634 | Sodium/hydrogen exchanger 1 | 83.56% | 90.24% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 83.06% | 88.56% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 82.68% | 100.00% |
| CHEMBL3012 | Q13946 | Phosphodiesterase 7A | 81.21% | 99.29% |
| CHEMBL1907601 | P11802 | Cyclin-dependent kinase 4/cyclin D1 | 81.14% | 98.99% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 81.12% | 85.30% |
| CHEMBL4829 | O00763 | Acetyl-CoA carboxylase 2 | 80.53% | 98.00% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 80.41% | 92.62% |
| CHEMBL4940 | P07195 | L-lactate dehydrogenase B chain | 80.31% | 95.53% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 163024483 |
| LOTUS | LTS0076416 |
| wikiData | Q104202395 |