2-(3-Hydroxy-3-methylbut-1-enyl)-5-(2-methylbut-3-en-2-yl)benzene-1,4-diol
| Internal ID | bc935c24-0919-4af2-bafc-fefc660d3117 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Quinone and hydroquinone lipids > Prenylated hydroquinones |
| IUPAC Name | 2-(3-hydroxy-3-methylbut-1-enyl)-5-(2-methylbut-3-en-2-yl)benzene-1,4-diol |
| SMILES (Canonical) | CC(C)(C=C)C1=C(C=C(C(=C1)O)C=CC(C)(C)O)O |
| SMILES (Isomeric) | CC(C)(C=C)C1=C(C=C(C(=C1)O)C=CC(C)(C)O)O |
| InChI | InChI=1S/C16H22O3/c1-6-15(2,3)12-10-13(17)11(9-14(12)18)7-8-16(4,5)19/h6-10,17-19H,1H2,2-5H3 |
| InChI Key | LXQUYFOONKATDQ-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C16H22O3 |
| Molecular Weight | 262.34 g/mol |
| Exact Mass | 262.15689456 g/mol |
| Topological Polar Surface Area (TPSA) | 60.70 Ų |
| XlogP | 3.50 |
| There are no found synonyms. |
| 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 | 95.88% | 91.11% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 91.08% | 94.73% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.04% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 87.07% | 98.95% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 85.58% | 86.33% |
| CHEMBL1977 | P11473 | Vitamin D receptor | 82.26% | 99.43% |
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.
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| There are no matching plants. |
| PubChem | 75972059 |
| LOTUS | LTS0066463 |
| wikiData | Q105159028 |