Methyl 2-methoxyoctacos-21-enoate
| Internal ID | d68d620b-7bff-443a-b9ab-b60fb1de1b18 |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty acid esters |
| IUPAC Name | methyl 2-methoxyoctacos-21-enoate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H58O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29(32-2)30(31)33-3/h9-10,29H,4-8,11-28H2,1-3H3 |
| InChI Key | MAJOLXCHPHSTDO-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C30H58O3 |
| Molecular Weight | 466.80 g/mol |
| Exact Mass | 466.43859571 g/mol |
| Topological Polar Surface Area (TPSA) | 35.50 Ų |
| XlogP | 12.80 |
| DTXSID20752236 |
| METHYL 2-METHOXYOCTACOS-21-ENOATE |
| 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 |
|---|---|---|---|---|
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 97.95% | 99.17% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.41% | 96.09% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 94.85% | 97.29% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 93.09% | 89.63% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 92.03% | 92.86% |
| CHEMBL2581 | P07339 | Cathepsin D | 91.81% | 98.95% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 89.90% | 91.81% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 89.17% | 96.95% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 88.19% | 92.08% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.02% | 94.45% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 86.69% | 94.33% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 86.61% | 100.00% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 86.00% | 100.00% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 84.62% | 97.21% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 83.73% | 96.00% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 83.24% | 95.71% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 83.02% | 97.00% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 82.64% | 91.11% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 82.35% | 90.17% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 82.32% | 96.00% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 81.86% | 91.19% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 81.67% | 98.03% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 81.50% | 87.45% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 80.80% | 94.73% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 80.66% | 100.00% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 80.58% | 93.56% |
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 | 71322572 |
| LOTUS | LTS0078667 |
| wikiData | Q82702837 |