Esulatin M
| Internal ID | de412a95-d7c8-4556-bd48-88961d48aff6 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Jatrophane and cyclojatrophane diterpenoids |
| IUPAC Name | [(1S,2S,3aR,5R,6E,9R,11R,13R,13aR)-1,3a,13-triacetyloxy-2,5,8,8-tetramethyl-12-methylidene-11-(2-methylpropoxy)-4-oxo-2,3,5,9,10,11,13,13a-octahydro-1H-cyclopenta[12]annulen-9-yl] pyridine-3-carboxylate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C36H49NO10/c1-20(2)19-43-28-16-29(46-34(42)27-12-11-15-37-18-27)35(9,10)14-13-21(3)33(41)36(47-26(8)40)17-22(4)31(44-24(6)38)30(36)32(23(28)5)45-25(7)39/h11-15,18,20-22,28-32H,5,16-17,19H2,1-4,6-10H3/b14-13+/t21-,22+,28-,29-,30-,31+,32+,36-/m1/s1 |
| InChI Key | NRLHNKOYUVCFAL-SLNBGHRSSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C36H49NO10 |
| Molecular Weight | 655.80 g/mol |
| Exact Mass | 655.33564676 g/mol |
| Topological Polar Surface Area (TPSA) | 144.00 Ų |
| XlogP | 5.30 |
| CHEMBL1812478 |
| 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 | 96.87% | 96.09% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 96.71% | 86.33% |
| CHEMBL2581 | P07339 | Cathepsin D | 96.70% | 98.95% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 96.31% | 91.49% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 96.19% | 89.34% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 94.73% | 97.79% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 93.98% | 97.25% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 91.55% | 85.14% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 91.45% | 90.17% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 86.10% | 99.23% |
| CHEMBL4481 | P35228 | Nitric oxide synthase, inducible | 86.05% | 94.80% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 85.75% | 94.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 85.58% | 91.11% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 84.97% | 89.00% |
| CHEMBL202 | P00374 | Dihydrofolate reductase | 84.66% | 89.92% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 84.24% | 90.00% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 84.22% | 98.75% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 83.95% | 95.89% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 83.78% | 94.45% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 83.01% | 97.09% |
| CHEMBL2007 | P16234 | Platelet-derived growth factor receptor alpha | 82.62% | 91.07% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 81.26% | 100.00% |
| CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 81.24% | 95.71% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 80.94% | 82.69% |
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.
| Euphorbia esula |
| PubChem | 56673097 |
| LOTUS | LTS0073481 |
| wikiData | Q105184647 |