N-[(4-hydroxy-3-methoxyphenyl)methyl]octanamide
| Internal ID | 0a65b9d1-6441-4c4c-b9b6-7db0c104977b |
| Taxonomy | Benzenoids > Phenols > Methoxyphenols |
| IUPAC Name | N-[(4-hydroxy-3-methoxyphenyl)methyl]octanamide |
| SMILES (Canonical) | CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC |
| SMILES (Isomeric) | CCCCCCCC(=O)NCC1=CC(=C(C=C1)O)OC |
| InChI | InChI=1S/C16H25NO3/c1-3-4-5-6-7-8-16(19)17-12-13-9-10-14(18)15(11-13)20-2/h9-11,18H,3-8,12H2,1-2H3,(H,17,19) |
| InChI Key | JYZDUDMWJFJCON-UHFFFAOYSA-N |
| Popularity | 11 references in papers |
| Molecular Formula | C16H25NO3 |
| Molecular Weight | 279.37 g/mol |
| Exact Mass | 279.18344366 g/mol |
| Topological Polar Surface Area (TPSA) | 58.60 Ų |
| XlogP | 3.60 |
| 58493-47-3 |
| N-Vanillyl octanamide |
| N-[(4-hydroxy-3-methoxyphenyl)methyl]octanamide |
| caprylic acid vanillylamide |
| CW938J9KNR |
| n-(4-hydroxy-3-methoxybenzyl)octanamide |
| N-((4-Hydroxy-3-methoxyphenyl)methyl)octanamide |
| Octanamide, N-((4-hydroxy-3-methoxyphenyl)methyl)- |
| Octanamide, N-[(4-hydroxy-3-methoxyphenyl)methyl]- |
| N-[(4-Hydroxy-3-methoxyphenyl)methyl]octanamide (N-Vanillyloctanamide) |
| There are more than 10 synonyms. If you wish to see them all click here. |
![2D Structure of N-[(4-hydroxy-3-methoxyphenyl)methyl]octanamide](https://plantaedb.com/storage/docs/compounds/2023/11/n-4-hydroxy-3-methoxyphenylmethyloctanamide.jpg "2D Structure of N-[(4-hydroxy-3-methoxyphenyl)methyl]octanamide")
| 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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 99.19% | 91.11% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 99.03% | 99.17% |
| CHEMBL2581 | P07339 | Cathepsin D | 98.75% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 97.46% | 96.09% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 94.55% | 92.08% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 91.93% | 97.29% |
| CHEMBL2535 | P11166 | Glucose transporter | 90.95% | 98.75% |
| CHEMBL1255126 | O15151 | Protein Mdm4 | 90.84% | 90.20% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 90.10% | 94.45% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 87.93% | 95.17% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 85.79% | 95.56% |
| CHEMBL5701 | Q9H2K8 | Serine/threonine-protein kinase TAO3 | 82.18% | 96.67% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 81.70% | 90.71% |
| CHEMBL3091268 | Q92753 | Nuclear receptor ROR-beta | 81.50% | 95.50% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 81.25% | 92.62% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 81.02% | 86.33% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 80.88% | 96.95% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 80.48% | 90.00% |
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.
| Capsicum annuum |
| PubChem | 5316427 |
| LOTUS | LTS0256730 |
| wikiData | Q105137301 |