[2,3-Dihydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propyl] 2-methylpropanoate
| Internal ID | da932066-0d9a-429c-ba2f-9a1e31b8e336 |
| Taxonomy | Benzenoids > Phenols > Methoxyphenols |
| IUPAC Name | [2,3-dihydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propyl] 2-methylpropanoate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C15H22O6/c1-9(2)14(18)21-8-15(19,7-16)11-6-13(20-4)10(3)5-12(11)17/h5-6,9,16-17,19H,7-8H2,1-4H3 |
| InChI Key | NHYWTEOXZLBTEL-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H22O6 |
| Molecular Weight | 298.33 g/mol |
| Exact Mass | 298.14163842 g/mol |
| Topological Polar Surface Area (TPSA) | 96.20 Ų |
| XlogP | 1.70 |
| There are no found synonyms. |
![2D Structure of [2,3-Dihydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propyl] 2-methylpropanoate](https://plantaedb.com/storage/docs/compounds/2023/11/23-dihydroxy-2-2-hydroxy-5-methoxy-4-methylphenylpropyl-2-methylpropanoate.jpg "2D Structure of [2,3-Dihydroxy-2-(2-hydroxy-5-methoxy-4-methylphenyl)propyl] 2-methylpropanoate")
| 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 | 96.13% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.62% | 96.09% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 92.01% | 89.62% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 90.81% | 99.15% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 89.58% | 85.14% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.52% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 89.26% | 98.95% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 88.88% | 99.17% |
| CHEMBL2535 | P11166 | Glucose transporter | 86.40% | 98.75% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 86.19% | 94.73% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 84.22% | 96.95% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 84.14% | 91.07% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 83.41% | 94.00% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 82.98% | 100.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 82.69% | 86.33% |
| CHEMBL3714130 | P46095 | G-protein coupled receptor 6 | 80.40% | 97.36% |
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.
| Schizogyne glaberrima |
| PubChem | 163008500 |
| LOTUS | LTS0128655 |
| wikiData | Q105179677 |