7-hydroxy-3-(5-hydroxy-8-methyl-1,7-dioxaspiro[5.5]undecan-2-yl)-5-methoxy-3H-2-benzofuran-1-one
| Internal ID | a8947c2e-e6de-449e-9fe3-1716fd773ee4 |
| Taxonomy | Organoheterocyclic compounds > Benzofurans > Benzofuranones |
| IUPAC Name | 7-hydroxy-3-(5-hydroxy-8-methyl-1,7-dioxaspiro[5.5]undecan-2-yl)-5-methoxy-3H-2-benzofuran-1-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H24O7/c1-10-4-3-7-19(25-10)15(21)6-5-14(26-19)17-12-8-11(23-2)9-13(20)16(12)18(22)24-17/h8-10,14-15,17,20-21H,3-7H2,1-2H3 |
| InChI Key | OJAFRAAQCYCPAI-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C19H24O7 |
| Molecular Weight | 364.40 g/mol |
| Exact Mass | 364.15220310 g/mol |
| Topological Polar Surface Area (TPSA) | 94.50 Ų |
| XlogP | 2.40 |
| There are no found synonyms. |
![2D Structure of 7-hydroxy-3-(5-hydroxy-8-methyl-1,7-dioxaspiro[5.5]undecan-2-yl)-5-methoxy-3H-2-benzofuran-1-one](https://plantaedb.com/storage/docs/compounds/2023/11/7-hydroxy-3-5-hydroxy-8-methyl-17-dioxaspiro55undecan-2-yl-5-methoxy-3h-2-benzofuran-1-one.jpg "2D Structure of 7-hydroxy-3-(5-hydroxy-8-methyl-1,7-dioxaspiro[5.5]undecan-2-yl)-5-methoxy-3H-2-benzofuran-1-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 | 99.07% | 91.11% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 97.09% | 97.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.66% | 95.56% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 96.62% | 85.14% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 93.84% | 91.07% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.32% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.75% | 98.95% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 90.55% | 99.23% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 90.14% | 92.62% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 90.02% | 93.99% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 88.77% | 99.18% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 88.70% | 99.15% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 87.40% | 94.00% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 87.35% | 95.89% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 86.33% | 89.00% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 85.40% | 92.94% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 83.11% | 86.33% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 82.89% | 94.45% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 82.60% | 90.00% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 82.02% | 94.75% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 81.46% | 91.71% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 81.44% | 97.05% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 80.79% | 97.14% |
| CHEMBL3880 | P07900 | Heat shock protein HSP 90-alpha | 80.48% | 96.21% |
| CHEMBL5697 | Q9GZT9 | Egl nine homolog 1 | 80.10% | 93.40% |
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 | 74928173 |
| LOTUS | LTS0055147 |
| wikiData | Q104193415 |