24-[3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyloxy]tetracosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
| Internal ID | 411477df-9555-4111-935b-a5c207021103 |
| Taxonomy | Phenylpropanoids and polyketides > Cinnamic acids and derivatives > Hydroxycinnamic acids and derivatives > Coumaric acids and derivatives |
| IUPAC Name | 24-[3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyloxy]tetracosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate |
| SMILES (Canonical) | COC1=C(C=CC(=C1)C=CC(=O)OCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
| SMILES (Isomeric) | COC1=C(C=CC(=C1)C=CC(=O)OCCCCCCCCCCCCCCCCCCCCCCCCOC(=O)C=CC2=CC(=C(C=C2)O)OC)O |
| InChI | InChI=1S/C44H66O8/c1-49-41-35-37(25-29-39(41)45)27-31-43(47)51-33-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-34-52-44(48)32-28-38-26-30-40(46)42(36-38)50-2/h25-32,35-36,45-46H,3-24,33-34H2,1-2H3 |
| InChI Key | JVYGWGTXGGTEAZ-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C44H66O8 |
| Molecular Weight | 723.00 g/mol |
| Exact Mass | 722.47576906 g/mol |
| Topological Polar Surface Area (TPSA) | 112.00 Ų |
| XlogP | 14.60 |
| There are no found synonyms. |
![2D Structure of 24-[3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyloxy]tetracosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate](https://plantaedb.com/storage/docs/compounds/2023/11/0951f510-8502-11ee-9199-07cad39fd78d.jpg "2D Structure of 24-[3-(4-Hydroxy-3-methoxyphenyl)prop-2-enoyloxy]tetracosyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate")
| 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 | 98.16% | 91.11% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 97.21% | 86.33% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.76% | 96.09% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 96.20% | 96.00% |
| CHEMBL3194 | P02766 | Transthyretin | 95.61% | 90.71% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 95.21% | 99.17% |
| CHEMBL225 | P28335 | Serotonin 2c (5-HT2c) receptor | 90.31% | 89.62% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.94% | 95.56% |
| CHEMBL2085 | P14174 | Macrophage migration inhibitory factor | 87.75% | 80.78% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 84.73% | 91.49% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 83.33% | 94.45% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.00% | 89.00% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 80.82% | 90.00% |
| CHEMBL3975 | P09467 | Fructose-1,6-bisphosphatase | 80.25% | 92.95% |
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.
| Hyoscyamus niger |
| Medinilla fengii |
| PubChem | 73156197 |
| LOTUS | LTS0259868 |
| wikiData | Q105136023 |