9E,11E-Hexadecadienal
| Internal ID | 855a89fa-f896-41a2-8db8-51bf47bf7ab9 |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty aldehydes |
| IUPAC Name | (9E,11E)-hexadeca-9,11-dienal |
| SMILES (Canonical) | CCCCC=CC=CCCCCCCCC=O |
| SMILES (Isomeric) | CCCC/C=C/C=C/CCCCCCCC=O |
| InChI | InChI=1S/C16H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-8,16H,2-4,9-15H2,1H3/b6-5+,8-7+ |
| InChI Key | YLYWMNJAJOQSGH-BSWSSELBSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C16H28O |
| Molecular Weight | 236.39 g/mol |
| Exact Mass | 236.214015512 g/mol |
| Topological Polar Surface Area (TPSA) | 17.10 Ų |
| XlogP | 5.70 |
| (9E,11E)-9,11-Hexadecadienal |
| E,Z-9,11-Hexadecadienal |
| SCHEMBL832094 |
| SCHEMBL1300810 |
| CHEBI:196154 |
| (9e,11e)-hexadeca-9,11-dienal |
| LMFA06000195 |
| 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 | 93.31% | 89.63% |
| CHEMBL2581 | P07339 | Cathepsin D | 93.10% | 98.95% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 91.71% | 92.08% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 90.46% | 99.17% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 88.87% | 97.29% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 87.06% | 85.94% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 86.91% | 96.09% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 84.27% | 92.86% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 84.01% | 89.34% |
| CHEMBL2664 | P23526 | Adenosylhomocysteinase | 82.42% | 86.67% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 82.23% | 90.17% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 81.18% | 97.00% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 80.74% | 96.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 80.43% | 94.73% |
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 | 12017757 |
| LOTUS | LTS0059423 |
| wikiData | Q105350389 |