1-[5-(1-Hydroxyethyl)-6-methoxy-1-benzofuran-2-yl]ethanone
Internal ID | c521a6ff-3fa7-4b74-a6e7-35c12c5d2590 |
Taxonomy | Organoheterocyclic compounds > Benzofurans |
IUPAC Name | 1-[5-(1-hydroxyethyl)-6-methoxy-1-benzofuran-2-yl]ethanone |
SMILES (Canonical) | CC(C1=C(C=C2C(=C1)C=C(O2)C(=O)C)OC)O |
SMILES (Isomeric) | CC(C1=C(C=C2C(=C1)C=C(O2)C(=O)C)OC)O |
InChI | InChI=1S/C13H14O4/c1-7(14)10-4-9-5-11(8(2)15)17-12(9)6-13(10)16-3/h4-7,14H,1-3H3 |
InChI Key | WAFNVCOPZBETII-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C13H14O4 |
Molecular Weight | 234.25 g/mol |
Exact Mass | 234.08920892 g/mol |
Topological Polar Surface Area (TPSA) | 59.70 Ų |
XlogP | 1.80 |
There are no found synonyms. |
![2D Structure of 1-[5-(1-Hydroxyethyl)-6-methoxy-1-benzofuran-2-yl]ethanone 2D Structure of 1-[5-(1-Hydroxyethyl)-6-methoxy-1-benzofuran-2-yl]ethanone](https://plantaedb.com/storage/docs/compounds/2023/11/1-5-1-hydroxyethyl-6-methoxy-1-benzofuran-2-ylethanone.jpg)
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 |
---|---|---|---|---|
CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 96.64% | 85.14% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.62% | 96.09% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 92.64% | 99.17% |
CHEMBL2581 | P07339 | Cathepsin D | 92.20% | 98.95% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 90.73% | 94.45% |
CHEMBL1255126 | O15151 | Protein Mdm4 | 89.12% | 90.20% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 88.24% | 94.00% |
CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 86.97% | 96.95% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 86.50% | 91.11% |
CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 85.09% | 89.50% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 83.80% | 86.33% |
CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 83.26% | 90.71% |
CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 83.05% | 92.29% |
CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 81.61% | 96.00% |
CHEMBL2535 | P11166 | Glucose transporter | 80.55% | 98.75% |
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.
Enceliopsis covillei |
Geraea canescens |
PubChem | 162933419 |
LOTUS | LTS0190030 |
wikiData | Q105156353 |