N-Benzyl-9-oxooctadec-12-enamide
| Internal ID | c8d35145-bde1-419c-9561-8ebd825a0c68 |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty amides > N-acyl amines |
| IUPAC Name | N-benzyl-9-oxooctadec-12-enamide |
| SMILES (Canonical) | CCCCCC=CCCC(=O)CCCCCCCC(=O)NCC1=CC=CC=C1 |
| SMILES (Isomeric) | CCCCCC=CCCC(=O)CCCCCCCC(=O)NCC1=CC=CC=C1 |
| InChI | InChI=1S/C25H39NO2/c1-2-3-4-5-6-8-14-19-24(27)20-15-9-7-10-16-21-25(28)26-22-23-17-12-11-13-18-23/h6,8,11-13,17-18H,2-5,7,9-10,14-16,19-22H2,1H3,(H,26,28) |
| InChI Key | NAPLCBOQGUNIRA-UHFFFAOYSA-N |
| Popularity | 1 reference in papers |
| Molecular Formula | C25H39NO2 |
| Molecular Weight | 385.60 g/mol |
| Exact Mass | 385.298079487 g/mol |
| Topological Polar Surface Area (TPSA) | 46.20 Ų |
| XlogP | 6.30 |
| 847361-88-0 |
| DTXSID00827496 |
| 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 | 99.35% | 98.95% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 98.62% | 99.17% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 98.22% | 90.17% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 96.88% | 92.08% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 95.26% | 91.11% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 92.19% | 97.00% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.32% | 96.09% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 90.78% | 97.29% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 90.52% | 95.56% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 89.62% | 94.73% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 88.96% | 89.63% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 88.67% | 95.50% |
| CHEMBL240 | Q12809 | HERG | 87.86% | 89.76% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 87.64% | 96.67% |
| CHEMBL3902 | P09211 | Glutathione S-transferase Pi | 82.79% | 93.81% |
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.
| Lepidium meyenii |
| PubChem | 71406899 |
| LOTUS | LTS0219199 |
| wikiData | Q82811909 |