(2R)-N-[(E,2S,3R,16R)-1,3-dihydroxy-16-methyloctadec-4-en-2-yl]-2-hydroxyhexadecanamide
| Internal ID | 961519a8-a246-42d3-b2e8-9edfb1a59724 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Secondary alcohols |
| IUPAC Name | (2R)-N-[(E,2S,3R,16R)-1,3-dihydroxy-16-methyloctadec-4-en-2-yl]-2-hydroxyhexadecanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C35H69NO4/c1-4-6-7-8-9-10-11-12-17-20-23-26-29-34(39)35(40)36-32(30-37)33(38)28-25-22-19-16-14-13-15-18-21-24-27-31(3)5-2/h25,28,31-34,37-39H,4-24,26-27,29-30H2,1-3H3,(H,36,40)/b28-25+/t31-,32+,33-,34-/m1/s1 |
| InChI Key | GLQLRVBXPWFPGT-JLYAFWPJSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C35H69NO4 |
| Molecular Weight | 567.90 g/mol |
| Exact Mass | 567.52265968 g/mol |
| Topological Polar Surface Area (TPSA) | 89.80 Ų |
| XlogP | 12.40 |
| There are no found synonyms. |
![2D Structure of (2R)-N-[(E,2S,3R,16R)-1,3-dihydroxy-16-methyloctadec-4-en-2-yl]-2-hydroxyhexadecanamide](https://plantaedb.com/storage/docs/compounds/2023/11/2r-n-e2s3r16r-13-dihydroxy-16-methyloctadec-4-en-2-yl-2-hydroxyhexadecanamide.jpg "2D Structure of (2R)-N-[(E,2S,3R,16R)-1,3-dihydroxy-16-methyloctadec-4-en-2-yl]-2-hydroxyhexadecanamide")
| 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 | 99.03% | 98.95% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 97.54% | 97.29% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 97.53% | 92.86% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 97.38% | 93.56% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 97.17% | 99.17% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 96.95% | 89.63% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 93.31% | 90.17% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 92.62% | 89.34% |
| CHEMBL1907591 | P30926 | Neuronal acetylcholine receptor; alpha4/beta4 | 91.99% | 100.00% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 91.54% | 92.08% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 90.70% | 96.09% |
| CHEMBL1907602 | P06493 | Cyclin-dependent kinase 1/cyclin B1 | 89.42% | 91.24% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 89.22% | 100.00% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 89.07% | 96.47% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 88.87% | 87.45% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 88.74% | 91.81% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 87.92% | 100.00% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 87.73% | 92.88% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 87.14% | 96.95% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 86.98% | 94.33% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 85.48% | 90.71% |
| CHEMBL4588 | P22894 | Matrix metalloproteinase 8 | 83.54% | 94.66% |
| CHEMBL3267 | P48736 | PI3-kinase p110-gamma subunit | 83.47% | 95.71% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 82.95% | 96.67% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 82.87% | 85.94% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 82.65% | 100.00% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 82.03% | 96.00% |
| CHEMBL3145 | P42338 | PI3-kinase p110-beta subunit | 81.99% | 98.75% |
| CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 81.89% | 89.50% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 81.83% | 94.73% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 81.73% | 98.03% |
| CHEMBL2664 | P23526 | Adenosylhomocysteinase | 81.60% | 86.67% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 81.00% | 95.50% |
| CHEMBL5261 | Q7L7X3 | Serine/threonine-protein kinase TAO1 | 80.93% | 89.33% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 80.91% | 91.19% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 80.65% | 94.45% |
| CHEMBL4015 | P41597 | C-C chemokine receptor type 2 | 80.28% | 98.57% |
| CHEMBL4657 | Q6V1X1 | Dipeptidyl peptidase VIII | 80.23% | 97.21% |
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 | 163041840 |
| LOTUS | LTS0206517 |
| wikiData | Q105011169 |