N-(1,3-dihydroxy-19-methylicos-4-en-2-yl)docosanamide
| Internal ID | 8ccc14a0-211b-4689-8184-26be8fae1ea8 |
| Taxonomy | Lipids and lipid-like molecules > Sphingolipids > Ceramides |
| IUPAC Name | N-(1,3-dihydroxy-19-methylicos-4-en-2-yl)docosanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C43H85NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26-29-32-35-38-43(47)44-41(39-45)42(46)37-34-31-28-25-22-19-17-18-21-24-27-30-33-36-40(2)3/h34,37,40-42,45-46H,4-33,35-36,38-39H2,1-3H3,(H,44,47) |
| InChI Key | GYZKYMROPRXLNV-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C43H85NO3 |
| Molecular Weight | 664.10 g/mol |
| Exact Mass | 663.65294557 g/mol |
| Topological Polar Surface Area (TPSA) | 69.60 Ų |
| XlogP | 17.50 |
| 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 |
|---|---|---|---|---|
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 99.79% | 89.63% |
| CHEMBL2581 | P07339 | Cathepsin D | 99.17% | 98.95% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 98.67% | 99.17% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 98.16% | 97.29% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 96.91% | 93.56% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 96.24% | 92.86% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 95.76% | 92.08% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 92.94% | 85.94% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 92.24% | 96.47% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 92.23% | 100.00% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 91.72% | 90.17% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 90.68% | 98.03% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.39% | 96.09% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 87.18% | 91.81% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 87.15% | 89.34% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 86.87% | 95.71% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 86.80% | 90.71% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 86.74% | 100.00% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 86.62% | 100.00% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 86.61% | 92.88% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 86.18% | 91.11% |
| CHEMBL1907602 | P06493 | Cyclin-dependent kinase 1/cyclin B1 | 85.75% | 91.24% |
| CHEMBL2664 | P23526 | Adenosylhomocysteinase | 85.62% | 86.67% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 85.02% | 87.45% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 84.90% | 94.33% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 84.42% | 94.73% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 83.57% | 96.00% |
| CHEMBL256 | P0DMS8 | Adenosine A3 receptor | 83.33% | 95.93% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 82.24% | 92.50% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 82.20% | 96.00% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 82.12% | 91.19% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 81.97% | 100.00% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 81.75% | 98.75% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 81.56% | 93.31% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 81.39% | 96.90% |
| CHEMBL1293316 | Q9HBX9 | Relaxin receptor 1 | 81.32% | 82.50% |
| CHEMBL4040 | P28482 | MAP kinase ERK2 | 81.06% | 83.82% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 80.53% | 96.95% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 80.24% | 96.67% |
| CHEMBL3976 | Q9UHL4 | Dipeptidyl peptidase II | 80.21% | 92.29% |
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 | 163026620 |
| LOTUS | LTS0077868 |
| wikiData | Q105024279 |