(9S)-2-(2,4-dihydroxyphenyl)-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methylbut-2-enyl)-9,10-dihydropyrano[2,3-h]chromen-4-one
| Internal ID | f48e0211-02e8-4194-a45e-1d0a7c881de0 |
| Taxonomy | Phenylpropanoids and polyketides > Flavonoids > Flavones > 8-prenylated flavones |
| IUPAC Name | (9S)-2-(2,4-dihydroxyphenyl)-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methylbut-2-enyl)-9,10-dihydropyrano[2,3-h]chromen-4-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H34O7/c1-15(2)7-10-19-25(34)24-26(35)20(11-8-16(3)4)28-21(14-23(33)30(5,6)37-28)29(24)36-27(19)18-12-9-17(31)13-22(18)32/h7-9,12-13,23,31-33,35H,10-11,14H2,1-6H3/t23-/m0/s1 |
| InChI Key | WVJAFZBCRQLHMH-QHCPKHFHSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C30H34O7 |
| Molecular Weight | 506.60 g/mol |
| Exact Mass | 506.23045342 g/mol |
| Topological Polar Surface Area (TPSA) | 116.00 Ų |
| XlogP | 6.50 |
| There are no found synonyms. |
![2D Structure of (9S)-2-(2,4-dihydroxyphenyl)-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methylbut-2-enyl)-9,10-dihydropyrano[2,3-h]chromen-4-one](https://plantaedb.com/storage/docs/compounds/2023/11/7fb16c40-85ce-11ee-9457-f1bd01544119.jpg "2D Structure of (9S)-2-(2,4-dihydroxyphenyl)-5,9-dihydroxy-8,8-dimethyl-3,6-bis(3-methylbut-2-enyl)-9,10-dihydropyrano[2,3-h]chromen-4-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 | 99.91% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.07% | 98.95% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 95.66% | 89.00% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 94.98% | 91.49% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.10% | 94.45% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 91.24% | 95.56% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 90.43% | 86.33% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 89.96% | 85.30% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 88.41% | 94.73% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 87.80% | 100.00% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 87.70% | 96.95% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 87.07% | 95.89% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 85.51% | 94.75% |
| CHEMBL3038469 | P24941 | CDK2/Cyclin A | 85.01% | 91.38% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 84.02% | 90.71% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 83.47% | 90.00% |
| CHEMBL3194 | P02766 | Transthyretin | 82.87% | 90.71% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 82.54% | 94.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.32% | 99.23% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 81.08% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 80.25% | 97.09% |
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.
| Dorstenia psilurus |
| PubChem | 162894156 |
| LOTUS | LTS0214123 |
| wikiData | Q105313553 |