Selesconol
| Internal ID | d30554aa-3f94-4211-a3cb-39e4b9d32a3c |
| Taxonomy | Benzenoids > Tetralins |
| IUPAC Name | 7,14,22-trihydroxyheptacyclo[13.11.2.12,6.011,28.018,27.021,26.010,29]nonacosa-1,3,6,8,10(29),11(28),12,14,21(26),22,24-undecaene-5,16,20-trione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C29H18O6/c30-17-3-1-2-15-25-16-6-9-19(32)28-18(31)7-4-13(24(16)28)14-5-8-20(33)29-22(35)11-12(23(25)27(14)29)10-21(34)26(15)17/h1-9,12,23,30-31,33H,10-11H2 |
| InChI Key | CGAKGJOUWCSJFA-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C29H18O6 |
| Molecular Weight | 462.40 g/mol |
| Exact Mass | 462.11033829 g/mol |
| Topological Polar Surface Area (TPSA) | 112.00 Ų |
| XlogP | 4.70 |
| There are no found synonyms. |
| 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 | 96.95% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.13% | 98.95% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.57% | 95.56% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 91.54% | 99.15% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 90.06% | 93.03% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 89.43% | 93.40% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 87.39% | 99.23% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 86.37% | 96.67% |
| CHEMBL2535 | P11166 | Glucose transporter | 83.78% | 98.75% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.64% | 97.09% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 82.51% | 82.69% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 82.35% | 100.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.78% | 95.89% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 80.22% | 91.49% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 80.14% | 92.88% |
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 | 132600633 |
| LOTUS | LTS0232365 |
| wikiData | Q75066788 |