(3Z)-3-(1-hydroxy-13-methyltetradecylidene)-1,5-dimethylpyrrolidine-2,4-dione
| Internal ID | 716d4dc8-b990-4868-8180-09ac6ead1e14 |
| Taxonomy | Organoheterocyclic compounds > Pyrrolidines > N-alkylpyrrolidines |
| IUPAC Name | (3Z)-3-(1-hydroxy-13-methyltetradecylidene)-1,5-dimethylpyrrolidine-2,4-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C21H37NO3/c1-16(2)14-12-10-8-6-5-7-9-11-13-15-18(23)19-20(24)17(3)22(4)21(19)25/h16-17,23H,5-15H2,1-4H3/b19-18- |
| InChI Key | DOKONNWENRHBTP-HNENSFHCSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C21H37NO3 |
| Molecular Weight | 351.50 g/mol |
| Exact Mass | 351.27734404 g/mol |
| Topological Polar Surface Area (TPSA) | 57.60 Ų |
| XlogP | 7.20 |
| There are no found synonyms. |
| 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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 97.95% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 96.87% | 96.09% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 91.03% | 97.25% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 89.90% | 90.71% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 89.65% | 94.75% |
| CHEMBL321 | P14780 | Matrix metalloproteinase 9 | 88.10% | 92.12% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 87.76% | 95.56% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 87.23% | 96.47% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 86.05% | 93.31% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 85.61% | 99.17% |
| CHEMBL325 | Q13547 | Histone deacetylase 1 | 84.17% | 95.92% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 84.06% | 93.56% |
| CHEMBL283 | P08254 | Matrix metalloproteinase 3 | 83.59% | 97.29% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 82.57% | 97.29% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 82.18% | 93.99% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 82.11% | 93.00% |
| CHEMBL332 | P03956 | Matrix metalloproteinase-1 | 80.78% | 94.50% |
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 | 135939158 |
| LOTUS | LTS0130944 |
| wikiData | Q27135313 |