11,17-Dihydroxy-7,7,20,20-tetramethyl-10-(3-methylbut-2-enyl)-2,8,19,25-tetraoxahexacyclo[12.11.0.03,12.04,9.015,24.018,23]pentacosa-1(14),3,5,9,11,15,17,21,23-nonaen-13-one
| Internal ID | ade804e8-3eea-45a5-b27e-4972c26005d7 |
| Taxonomy | Phenylpropanoids and polyketides > Isoflavonoids > Isoflavans > Isoflavanones > 6-prenylated isoflavanones |
| IUPAC Name | 11,17-dihydroxy-7,7,20,20-tetramethyl-10-(3-methylbut-2-enyl)-2,8,19,25-tetraoxahexacyclo[12.11.0.03,12.04,9.015,24.018,23]pentacosa-1(14),3,5,9,11,15,17,21,23-nonaen-13-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H28O7/c1-14(2)7-8-15-22(32)21-23(33)20-18-13-19(31)26-16(9-11-30(5,6)37-26)24(18)34-28(20)35-27(21)17-10-12-29(3,4)36-25(15)17/h7,9-13,31-32H,8H2,1-6H3 |
| InChI Key | GSSXYBUOGUMBFR-UHFFFAOYSA-N |
| Popularity | 4 references in papers |
| Molecular Formula | C30H28O7 |
| Molecular Weight | 500.50 g/mol |
| Exact Mass | 500.18350323 g/mol |
| Topological Polar Surface Area (TPSA) | 98.40 Ų |
| XlogP | 7.30 |
| There are no found synonyms. |
![2D Structure of 11,17-Dihydroxy-7,7,20,20-tetramethyl-10-(3-methylbut-2-enyl)-2,8,19,25-tetraoxahexacyclo[12.11.0.03,12.04,9.015,24.018,23]pentacosa-1(14),3,5,9,11,15,17,21,23-nonaen-13-one](https://plantaedb.com/storage/docs/compounds/2023/11/f420d460-8438-11ee-a53c-d74b591dd5c1.jpg "2D Structure of 11,17-Dihydroxy-7,7,20,20-tetramethyl-10-(3-methylbut-2-enyl)-2,8,19,25-tetraoxahexacyclo[12.11.0.03,12.04,9.015,24.018,23]pentacosa-1(14),3,5,9,11,15,17,21,23-nonaen-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 | 99.87% | 91.11% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 97.63% | 94.45% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 97.26% | 91.49% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.03% | 98.95% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 94.98% | 89.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 92.40% | 94.73% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 91.69% | 89.34% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 90.97% | 94.75% |
| CHEMBL3038469 | P24941 | CDK2/Cyclin A | 90.03% | 91.38% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 86.92% | 95.56% |
| CHEMBL2964 | P36507 | Dual specificity mitogen-activated protein kinase kinase 2 | 86.49% | 80.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.50% | 86.33% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 84.86% | 92.29% |
| CHEMBL4224 | P49759 | Dual specificty protein kinase CLK1 | 83.38% | 85.30% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 83.31% | 94.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 82.46% | 95.89% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 82.18% | 93.99% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 82.03% | 99.23% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 82.03% | 99.15% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 81.17% | 99.17% |
| CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 80.49% | 95.71% |
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.
| Euchresta formosana |
| Euchresta tubulosa |
| PubChem | 85617815 |
| LOTUS | LTS0209110 |
| wikiData | Q104402339 |