Methyl 1,3,4-tris(4-hydroxyphenyl)pyrrole-2-carboxylate
| Internal ID | 4db6d3ba-64ff-4f83-a8a0-76558ae10013 |
| Taxonomy | Organoheterocyclic compounds > Pyrroles > Substituted pyrroles > Phenylpyrroles |
| IUPAC Name | methyl 1,3,4-tris(4-hydroxyphenyl)pyrrole-2-carboxylate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H19NO5/c1-30-24(29)23-22(16-4-10-19(27)11-5-16)21(15-2-8-18(26)9-3-15)14-25(23)17-6-12-20(28)13-7-17/h2-14,26-28H,1H3 |
| InChI Key | FXJUUBGKHDHCBO-UHFFFAOYSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C24H19NO5 |
| Molecular Weight | 401.40 g/mol |
| Exact Mass | 401.12632271 g/mol |
| Topological Polar Surface Area (TPSA) | 91.90 Ų |
| XlogP | 4.70 |
| SCHEMBL13595362 |
| Methyl 1,3,4-tris(4-hydroxyphenyl)pyrrole-2-carboxylate |
| 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 | 96.80% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 96.24% | 98.95% |
| CHEMBL4016 | P42262 | Glutamate receptor ionotropic, AMPA 2 | 91.45% | 86.92% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 88.67% | 86.33% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 86.98% | 91.79% |
| CHEMBL2107 | P61073 | C-X-C chemokine receptor type 4 | 86.10% | 93.10% |
| CHEMBL2345 | P51812 | Ribosomal protein S6 kinase alpha 3 | 84.46% | 95.64% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 83.69% | 85.14% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 83.65% | 94.00% |
| CHEMBL2276 | P45983 | c-Jun N-terminal kinase 1 | 83.03% | 96.90% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 82.82% | 94.33% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 82.00% | 99.17% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 80.02% | 91.11% |
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 | 10023974 |
| LOTUS | LTS0091258 |
| wikiData | Q105003976 |