4,2',4'-Trihydroxy-3-methoxydihydrochalcone
Internal ID | 73c2be70-f636-4564-b10c-69e419692170 |
Taxonomy | Phenylpropanoids and polyketides > Linear 1,3-diarylpropanoids > Chalcones and dihydrochalcones > 2-Hydroxy-dihydrochalcones |
IUPAC Name | 1-(2,4-dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)propan-1-one |
SMILES (Canonical) | COC1=C(C=CC(=C1)CCC(=O)C2=C(C=C(C=C2)O)O)O |
SMILES (Isomeric) | COC1=C(C=CC(=C1)CCC(=O)C2=C(C=C(C=C2)O)O)O |
InChI | InChI=1S/C16H16O5/c1-21-16-8-10(3-7-14(16)19)2-6-13(18)12-5-4-11(17)9-15(12)20/h3-5,7-9,17,19-20H,2,6H2,1H3 |
InChI Key | NKLQEBAADGTJCF-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C16H16O5 |
Molecular Weight | 288.29 g/mol |
Exact Mass | 288.09977361 g/mol |
Topological Polar Surface Area (TPSA) | 87.00 Ų |
XlogP | 3.00 |
SCHEMBL1840837 |
CHEBI:197220 |
LMPK12120458 |
1-(2,4-dihydroxyphenyl)-3-(4-hydroxy-3-methoxyphenyl)propan-1-one |
![2D Structure of 4,2',4'-Trihydroxy-3-methoxydihydrochalcone 2D Structure of 4,2',4'-Trihydroxy-3-methoxydihydrochalcone](https://plantaedb.com/storage/docs/compounds/2023/11/424-trihydroxy-3-methoxydihydrochalcone.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 |
---|---|---|---|---|
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.10% | 96.09% |
CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.52% | 91.11% |
CHEMBL2581 | P07339 | Cathepsin D | 94.96% | 98.95% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 94.30% | 99.17% |
CHEMBL2535 | P11166 | Glucose transporter | 93.10% | 98.75% |
CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.82% | 86.33% |
CHEMBL4208 | P20618 | Proteasome component C5 | 90.78% | 90.00% |
CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 90.68% | 94.45% |
CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 90.41% | 95.17% |
CHEMBL1255126 | O15151 | Protein Mdm4 | 87.57% | 90.20% |
CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 86.62% | 95.50% |
CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 86.08% | 95.56% |
CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 84.53% | 94.00% |
CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 84.49% | 99.15% |
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.
Iryanthera polyneura |
PubChem | 21722167 |
LOTUS | LTS0058935 |
wikiData | Q104172592 |