2'-Hydroxyfurano[2'',3'':4',3']chalcone
Internal ID | 0a52f3fa-8c58-48e6-aa28-b1c57c7e7d98 |
Taxonomy | Phenylpropanoids and polyketides > Linear 1,3-diarylpropanoids > Chalcones and dihydrochalcones > Furanochalcones |
IUPAC Name | (E)-1-(4-hydroxy-1-benzofuran-5-yl)-3-phenylprop-2-en-1-one |
SMILES (Canonical) | C1=CC=C(C=C1)C=CC(=O)C2=C(C3=C(C=C2)OC=C3)O |
SMILES (Isomeric) | C1=CC=C(C=C1)/C=C/C(=O)C2=C(C3=C(C=C2)OC=C3)O |
InChI | InChI=1S/C17H12O3/c18-15(8-6-12-4-2-1-3-5-12)13-7-9-16-14(17(13)19)10-11-20-16/h1-11,19H/b8-6+ |
InChI Key | WXWGKIBMPDYPTH-SOFGYWHQSA-N |
Popularity | 2 references in papers |
Molecular Formula | C17H12O3 |
Molecular Weight | 264.27 g/mol |
Exact Mass | 264.078644241 g/mol |
Topological Polar Surface Area (TPSA) | 50.40 Ų |
XlogP | 4.30 |
CHEMBL2259856 |
CHEBI:168932 |
LMPK12120002 |
(E)-1-(4-hydroxy-1-benzouran-5-yl)-3-phenylprop-2-en-1-one |
(E)-1-(4-hydroxybenzofuran-5-yl)-3-phenyl-prop-2-en-1-one |
(e)-1-(4-hydroxybenzofuran-5-yl)-3-phenylprop-2-en-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 | 98.63% | 91.11% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.95% | 95.56% |
CHEMBL1951 | P21397 | Monoamine oxidase A | 90.54% | 91.49% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 89.19% | 86.33% |
CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 88.21% | 99.23% |
CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 87.12% | 89.00% |
CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 85.75% | 96.00% |
CHEMBL2581 | P07339 | Cathepsin D | 84.39% | 98.95% |
CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 84.24% | 95.50% |
CHEMBL3401 | O75469 | Pregnane X receptor | 80.96% | 94.73% |
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.
Derris ovalifolia |
Millettia pulchra |
PubChem | 13963932 |
LOTUS | LTS0175523 |
wikiData | Q76423476 |