(3,5-Dimethoxy-9-oxoxanthen-1-yl) octadecanoate
| Internal ID | 8f6cca23-69b6-495b-8c31-5ff82c211819 |
| Taxonomy | Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Xanthones |
| IUPAC Name | (3,5-dimethoxy-9-oxoxanthen-1-yl) octadecanoate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C33H46O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-30(34)38-28-23-25(36-2)24-29-31(28)32(35)26-20-19-21-27(37-3)33(26)39-29/h19-21,23-24H,4-18,22H2,1-3H3 |
| InChI Key | KAMFLGVSMZJLKC-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C33H46O6 |
| Molecular Weight | 538.70 g/mol |
| Exact Mass | 538.32943918 g/mol |
| Topological Polar Surface Area (TPSA) | 71.10 Ų |
| XlogP | 11.10 |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 97.94% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 97.68% | 91.11% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 97.21% | 92.08% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 97.18% | 99.17% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.99% | 95.56% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 95.17% | 93.31% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.65% | 96.09% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 92.78% | 89.00% |
| CHEMBL2535 | P11166 | Glucose transporter | 92.19% | 98.75% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.34% | 86.33% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 91.16% | 99.23% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 90.58% | 94.45% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 89.69% | 92.62% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 88.68% | 95.50% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 87.75% | 93.99% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 87.17% | 96.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 87.02% | 94.73% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 85.20% | 85.94% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 82.00% | 94.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.39% | 95.89% |
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.
| Swertia hookeri |
| PubChem | 162969332 |
| LOTUS | LTS0202920 |
| wikiData | Q105137898 |