N-(2-(1H-Indol-1-yl)ethyl)icosanamide
| Internal ID | f0ad75ac-ef4e-490c-a9b1-3ee9cd061bbb |
| Taxonomy | Organoheterocyclic compounds > Indoles and derivatives > N-alkylindoles |
| IUPAC Name | N-(2-indol-1-ylethyl)icosanamide |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H50N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-30(33)31-25-27-32-26-24-28-21-19-20-22-29(28)32/h19-22,24,26H,2-18,23,25,27H2,1H3,(H,31,33) |
| InChI Key | NBCVECUGDUAJNM-UHFFFAOYSA-N |
| Popularity | 4 references in papers |
| Molecular Formula | C30H50N2O |
| Molecular Weight | 454.70 g/mol |
| Exact Mass | 454.392314223 g/mol |
| Topological Polar Surface Area (TPSA) | 34.00 Ų |
| XlogP | 10.70 |
| N-[2-(1H-Indol-1-yl)ethyl]icosanamide |
| N-(2-(1H-Indol-1-yl)ethyl)icosanamide |
| RefChem:360280 |
| DTXCID40534278 |
| N-(2-indol-1-ylethyl)icosanamide |
| Eicosanoic acid tryptamide |
| 152766-92-2 |
| Eicosanoic acid tryptamide, standard for HPLC |
| 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 | 98.49% | 98.95% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 97.67% | 89.63% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.19% | 96.09% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 95.03% | 99.17% |
| CHEMBL240 | Q12809 | HERG | 94.65% | 89.76% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 92.84% | 92.08% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 91.72% | 99.23% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 90.62% | 85.94% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 89.17% | 82.69% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 88.87% | 90.17% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 87.24% | 94.73% |
| CHEMBL4179 | P45984 | c-Jun N-terminal kinase 2 | 84.47% | 90.75% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 82.68% | 97.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 82.53% | 86.33% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 82.50% | 97.29% |
| CHEMBL5261 | Q7L7X3 | Serine/threonine-protein kinase TAO1 | 81.53% | 89.33% |
| CHEMBL1936 | P10721 | Stem cell growth factor receptor | 80.48% | 84.17% |
| CHEMBL3891 | P07384 | Calpain 1 | 80.44% | 93.04% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 80.40% | 95.56% |
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.
| Annona mucosa |
| PubChem | 16211905 |
| LOTUS | LTS0131861 |
| wikiData | Q82475084 |