(1,4-Diacetyloxy-5-cyano-7-hydroxy-3-methyl-6,11-dioxo-1,2,3,4-tetrahydrobenzo[b]carbazol-2-yl) acetate
| Internal ID | 4d6e09ed-01a4-4f23-a624-01778531d209 |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > Carbazoles |
| IUPAC Name | (1,4-diacetyloxy-5-cyano-7-hydroxy-3-methyl-6,11-dioxo-1,2,3,4-tetrahydrobenzo[b]carbazol-2-yl) acetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H20N2O9/c1-9-22(33-10(2)27)19-17(24(35-12(4)29)23(9)34-11(3)28)16-18(26(19)8-25)21(32)15-13(20(16)31)6-5-7-14(15)30/h5-7,9,22-24,30H,1-4H3 |
| InChI Key | CLWRIZLHGISADS-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C24H20N2O9 |
| Molecular Weight | 480.40 g/mol |
| Exact Mass | 480.11688022 g/mol |
| Topological Polar Surface Area (TPSA) | 162.00 Ų |
| XlogP | 2.30 |
| There are no found synonyms. |
![2D Structure of (1,4-Diacetyloxy-5-cyano-7-hydroxy-3-methyl-6,11-dioxo-1,2,3,4-tetrahydrobenzo[b]carbazol-2-yl) acetate](https://plantaedb.com/storage/docs/compounds/2023/11/8c833d00-82f7-11ee-8a5d-995d2fe18188.jpg "2D Structure of (1,4-Diacetyloxy-5-cyano-7-hydroxy-3-methyl-6,11-dioxo-1,2,3,4-tetrahydrobenzo[b]carbazol-2-yl) acetate")
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 98.52% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.23% | 96.09% |
| CHEMBL4685 | P14902 | Indoleamine 2,3-dioxygenase | 96.22% | 96.38% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 94.70% | 99.23% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 94.28% | 89.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.54% | 95.56% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 91.09% | 91.49% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 89.24% | 91.11% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 88.81% | 86.33% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 88.42% | 82.69% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.32% | 85.14% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 85.13% | 91.19% |
| CHEMBL4016 | P42262 | Glutamate receptor ionotropic, AMPA 2 | 84.90% | 86.92% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 83.85% | 99.15% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 83.35% | 97.21% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 82.53% | 96.67% |
| CHEMBL245 | P20309 | Muscarinic acetylcholine receptor M3 | 82.15% | 97.53% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 81.91% | 92.94% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 162816392 |
| LOTUS | LTS0010886 |
| wikiData | Q103817854 |