N-[2-methoxy-2-[4-(3-methylbut-2-enoxy)phenyl]ethyl]-3-phenylprop-2-enamide
| Internal ID | 4cb7a420-400e-4974-8172-b181ae345ae9 |
| Taxonomy | Phenylpropanoids and polyketides > Cinnamic acids and derivatives > Cinnamic acid amides |
| IUPAC Name | N-[2-methoxy-2-[4-(3-methylbut-2-enoxy)phenyl]ethyl]-3-phenylprop-2-enamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C23H27NO3/c1-18(2)15-16-27-21-12-10-20(11-13-21)22(26-3)17-24-23(25)14-9-19-7-5-4-6-8-19/h4-15,22H,16-17H2,1-3H3,(H,24,25) |
| InChI Key | MLCNANOYWKNAAF-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C23H27NO3 |
| Molecular Weight | 365.50 g/mol |
| Exact Mass | 365.19909372 g/mol |
| Topological Polar Surface Area (TPSA) | 47.60 Ų |
| XlogP | 4.50 |
| There are no found synonyms. |
![2D Structure of N-[2-methoxy-2-[4-(3-methylbut-2-enoxy)phenyl]ethyl]-3-phenylprop-2-enamide](https://plantaedb.com/storage/docs/compounds/2023/11/n-2-methoxy-2-4-3-methylbut-2-enoxyphenylethyl-3-phenylprop-2-enamide.jpg "2D Structure of N-[2-methoxy-2-[4-(3-methylbut-2-enoxy)phenyl]ethyl]-3-phenylprop-2-enamide")
| 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 |
|---|---|---|---|---|
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 97.13% | 96.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 97.10% | 91.11% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.32% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.07% | 98.95% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 94.69% | 90.17% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 93.79% | 86.33% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 93.55% | 90.00% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 93.53% | 99.17% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 90.57% | 94.73% |
| CHEMBL2563 | Q9UQL6 | Histone deacetylase 5 | 89.71% | 89.67% |
| CHEMBL2039 | P27338 | Monoamine oxidase B | 87.11% | 92.51% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 86.51% | 95.56% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 86.19% | 95.50% |
| CHEMBL3902 | P09211 | Glutathione S-transferase Pi | 84.09% | 93.81% |
| CHEMBL1293277 | O15118 | Niemann-Pick C1 protein | 83.79% | 81.11% |
| CHEMBL2716 | Q8WUI4 | Histone deacetylase 7 | 82.42% | 89.44% |
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.
| Aegle marmelos |
| PubChem | 163044515 |
| LOTUS | LTS0101848 |
| wikiData | Q105166493 |