1-Methyl-18-oxa-7,10,11-triazahexacyclo[15.6.1.02,15.04,13.06,11.020,24]tetracosa-2(15),3,6,13,17(24),19-hexaene-5,12,16,21-tetrone
| Internal ID | 3ecccd78-a4b2-4758-873d-35bed28c4ca3 |
| Taxonomy | Benzenoids > Phenanthrenes and derivatives |
| IUPAC Name | 1-methyl-18-oxa-7,10,11-triazahexacyclo[15.6.1.02,15.04,13.06,11.020,24]tetracosa-2(15),3,6,13,17(24),19-hexaene-5,12,16,21-tetrone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C21H15N3O5/c1-21-3-2-14(25)12-8-29-18(15(12)21)16(26)11-6-10-9(7-13(11)21)17(27)19-22-4-5-23-24(19)20(10)28/h6-8,23H,2-5H2,1H3 |
| InChI Key | HAPLJBDDSRTANZ-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C21H15N3O5 |
| Molecular Weight | 389.40 g/mol |
| Exact Mass | 389.10117059 g/mol |
| Topological Polar Surface Area (TPSA) | 109.00 Ų |
| XlogP | 1.20 |
| There are no found synonyms. |
![2D Structure of 1-Methyl-18-oxa-7,10,11-triazahexacyclo[15.6.1.02,15.04,13.06,11.020,24]tetracosa-2(15),3,6,13,17(24),19-hexaene-5,12,16,21-tetrone](https://plantaedb.com/storage/docs/compounds/2023/11/65563530-85ca-11ee-bb05-81b79636be43.jpg "2D Structure of 1-Methyl-18-oxa-7,10,11-triazahexacyclo[15.6.1.02,15.04,13.06,11.020,24]tetracosa-2(15),3,6,13,17(24),19-hexaene-5,12,16,21-tetrone")
| 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 | 96.40% | 93.40% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 95.64% | 96.38% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.15% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.53% | 96.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 92.32% | 86.33% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.80% | 95.56% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 89.56% | 99.23% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 88.27% | 96.21% |
| CHEMBL4072 | P07858 | Cathepsin B | 87.84% | 93.67% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 87.38% | 96.67% |
| CHEMBL4302 | P08183 | P-glycoprotein 1 | 86.87% | 92.98% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 86.33% | 96.77% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 84.29% | 94.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 83.58% | 91.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.49% | 89.00% |
| CHEMBL2107 | P61073 | C-X-C chemokine receptor type 4 | 83.06% | 93.10% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.94% | 90.71% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.10% | 95.89% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 81.96% | 85.14% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 80.81% | 94.73% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 80.51% | 97.09% |
| CHEMBL3713062 | P10646 | Tissue factor pathway inhibitor | 80.40% | 97.33% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 80.39% | 94.45% |
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 | 21575338 |
| LOTUS | LTS0198686 |
| wikiData | Q105024984 |