3-(2,3,4-Trihydroxy-phenyl)-acrylic acid
| Internal ID | f68b588d-dcac-49ff-8f56-870e4502ce00 |
| Taxonomy | Phenylpropanoids and polyketides > Cinnamic acids and derivatives > Hydroxycinnamic acids and derivatives > Hydroxycinnamic acids |
| IUPAC Name | (E)-3-(2,3,4-trihydroxyphenyl)prop-2-enoic acid |
| SMILES (Canonical) | C1=CC(=C(C(=C1C=CC(=O)O)O)O)O |
| SMILES (Isomeric) | C1=CC(=C(C(=C1/C=C/C(=O)O)O)O)O |
| InChI | InChI=1S/C9H8O5/c10-6-3-1-5(2-4-7(11)12)8(13)9(6)14/h1-4,10,13-14H,(H,11,12)/b4-2+ |
| InChI Key | RHGWNBSOWGUGPA-DUXPYHPUSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C9H8O5 |
| Molecular Weight | 196.16 g/mol |
| Exact Mass | 196.03717335 g/mol |
| Topological Polar Surface Area (TPSA) | 98.00 Ų |
| XlogP | 0.80 |
| 3-(2,3,4-TRIHYDROXY-PHENYL)-ACRYLIC ACID |
| (E)-3-(2,3,4-TRIHYDROXYPHENYL)PROP-2-ENOIC ACID |
| 3-(2,3,4-trihydroxyphenyl)acrylic acid |
| (E)-3-(2,3,4-Trihydroxyphenyl)acrylic acid |
| 2-Propenoic acid, 3-(2,3,4-trihydroxyphenyl)- |
| SCHEMBL89143 |
| SCHEMBL89145 |
| MFCD03002815 |
| AKOS006276066 |
| AS-50442 |
| There are more than 10 synonyms. If you wish to see them all click here. |
| 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 | 97.34% | 91.11% |
| CHEMBL3194 | P02766 | Transthyretin | 92.54% | 90.71% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 90.38% | 91.49% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.42% | 95.56% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 84.14% | 94.62% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 84.04% | 86.33% |
| CHEMBL1860 | P10827 | Thyroid hormone receptor alpha | 83.67% | 99.15% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 82.71% | 96.00% |
| CHEMBL1163101 | O75460 | Serine/threonine-protein kinase/endoribonuclease IRE1 | 81.69% | 98.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 81.17% | 89.00% |
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.
| Olea europaea |
| PubChem | 21889163 |
| LOTUS | LTS0114810 |
| wikiData | Q76512169 |