10-(2-Hydroperoxy-3-methylbut-2-enyl)-11,22-dihydroxy-7,7,19,19-tetramethyl-2,8,20-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),3,5,9,11,15,17,21-octaen-13-one
| Internal ID | b30e606f-5adc-404c-a8ca-c2b5bfdf5d4a |
| Taxonomy | Organoheterocyclic compounds > Benzopyrans > 1-benzopyrans > Xanthones > 2-prenylated xanthones |
| IUPAC Name | 10-(2-hydroperoxy-3-methylbut-2-enyl)-11,22-dihydroxy-7,7,19,19-tetramethyl-2,8,20-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),3,5,9,11,15,17,21-octaen-13-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C28H28O8/c1-13(2)18(36-32)12-17-21(30)19-20(29)16-11-14-7-9-27(3,4)34-23(14)22(31)26(16)33-25(19)15-8-10-28(5,6)35-24(15)17/h7-11,30-32H,12H2,1-6H3 |
| InChI Key | AYNRFDZREQAQQD-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C28H28O8 |
| Molecular Weight | 492.50 g/mol |
| Exact Mass | 492.17841785 g/mol |
| Topological Polar Surface Area (TPSA) | 115.00 Ų |
| XlogP | 5.80 |
| There are no found synonyms. |
![2D Structure of 10-(2-Hydroperoxy-3-methylbut-2-enyl)-11,22-dihydroxy-7,7,19,19-tetramethyl-2,8,20-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),3,5,9,11,15,17,21-octaen-13-one](https://plantaedb.com/storage/docs/compounds/2023/11/c3440b80-867c-11ee-921f-2df818e44a0a.jpg "2D Structure of 10-(2-Hydroperoxy-3-methylbut-2-enyl)-11,22-dihydroxy-7,7,19,19-tetramethyl-2,8,20-trioxapentacyclo[12.8.0.03,12.04,9.016,21]docosa-1(14),3,5,9,11,15,17,21-octaen-13-one")
| 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 | 99.65% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 96.09% | 94.45% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.06% | 98.95% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 94.94% | 89.00% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 88.91% | 89.34% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 88.55% | 91.49% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 88.44% | 94.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 86.05% | 94.73% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 85.71% | 85.14% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 84.74% | 95.56% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 84.49% | 94.75% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.28% | 95.89% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.85% | 99.23% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 80.53% | 93.99% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 80.41% | 99.15% |
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.
| Garcinia latissima |
| PubChem | 102505133 |
| LOTUS | LTS0081730 |
| wikiData | Q104921280 |