8-[[2,4-Dihydroxy-3-[3-(4-hydroxyphenyl)propanoyl]-6-methoxy-5-methylphenyl]methyl]-5,7-dihydroxy-3-methoxy-2-phenylchromen-4-one
| Internal ID | e851e339-a0eb-4299-948b-e9910871d4bb |
| Taxonomy | Phenylpropanoids and polyketides > Diarylheptanoids > Linear diarylheptanoids |
| IUPAC Name | 8-[[2,4-dihydroxy-3-[3-(4-hydroxyphenyl)propanoyl]-6-methoxy-5-methylphenyl]methyl]-5,7-dihydroxy-3-methoxy-2-phenylchromen-4-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C34H30O10/c1-17-28(39)26(23(36)14-11-18-9-12-20(35)13-10-18)29(40)22(31(17)42-2)15-21-24(37)16-25(38)27-30(41)34(43-3)32(44-33(21)27)19-7-5-4-6-8-19/h4-10,12-13,16,35,37-40H,11,14-15H2,1-3H3 |
| InChI Key | ACWNFYVDJXNVHA-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C34H30O10 |
| Molecular Weight | 598.60 g/mol |
| Exact Mass | 598.18389715 g/mol |
| Topological Polar Surface Area (TPSA) | 163.00 Ų |
| XlogP | 6.50 |
| There are no found synonyms. |
![2D Structure of 8-[[2,4-Dihydroxy-3-[3-(4-hydroxyphenyl)propanoyl]-6-methoxy-5-methylphenyl]methyl]-5,7-dihydroxy-3-methoxy-2-phenylchromen-4-one](https://plantaedb.com/storage/docs/compounds/2023/11/7a943e60-8830-11ee-93c9-c7c9b077ddee.jpg "2D Structure of 8-[[2,4-Dihydroxy-3-[3-(4-hydroxyphenyl)propanoyl]-6-methoxy-5-methylphenyl]methyl]-5,7-dihydroxy-3-methoxy-2-phenylchromen-4-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 | 99.21% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.20% | 98.95% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 97.40% | 95.50% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 95.35% | 86.33% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 94.59% | 94.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 94.31% | 95.56% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 94.21% | 99.17% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 91.54% | 96.95% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 91.03% | 89.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 90.42% | 94.45% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 90.36% | 95.17% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 90.21% | 99.15% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 88.98% | 94.73% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 85.82% | 97.21% |
| CHEMBL5939 | Q9NZ08 | Endoplasmic reticulum aminopeptidase 1 | 85.34% | 100.00% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 84.70% | 91.71% |
| CHEMBL2095172 | P14867 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 82.53% | 92.67% |
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.
| There are no matching plants. |
| PubChem | 102066683 |
| LOTUS | LTS0234051 |
| wikiData | Q104909344 |