5-(12-Phenyldodec-8-enyl)benzene-1,3-diol
| Internal ID | 8cce74ff-4fe9-475a-9f5c-faa9eaa8d1f7 |
| Taxonomy | Benzenoids > Phenols > Benzenediols > Resorcinols |
| IUPAC Name | 5-(12-phenyldodec-8-enyl)benzene-1,3-diol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H32O2/c25-23-18-22(19-24(26)20-23)17-11-8-6-4-2-1-3-5-7-10-14-21-15-12-9-13-16-21/h3,5,9,12-13,15-16,18-20,25-26H,1-2,4,6-8,10-11,14,17H2 |
| InChI Key | KPPSMCABJGUZGW-UHFFFAOYSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C24H32O2 |
| Molecular Weight | 352.50 g/mol |
| Exact Mass | 352.240230259 g/mol |
| Topological Polar Surface Area (TPSA) | 40.50 Ų |
| XlogP | 7.90 |
| There are no found synonyms. |
| 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 | 96.80% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 96.35% | 98.95% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 94.67% | 99.17% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 94.30% | 94.62% |
| CHEMBL240 | Q12809 | HERG | 93.24% | 89.76% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 90.40% | 86.33% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 87.99% | 95.56% |
| CHEMBL5805 | Q9NR97 | Toll-like receptor 8 | 87.87% | 96.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 87.51% | 96.09% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 87.27% | 91.71% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 86.83% | 92.08% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 85.99% | 94.73% |
| CHEMBL3891 | P07384 | Calpain 1 | 85.37% | 93.04% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 83.37% | 97.00% |
| CHEMBL233 | P35372 | Mu opioid receptor | 82.09% | 97.93% |
| CHEMBL3902 | P09211 | Glutathione S-transferase Pi | 81.49% | 93.81% |
| CHEMBL3202 | P48147 | Prolyl endopeptidase | 81.10% | 90.65% |
| CHEMBL3761 | Q9HCG7 | Beta-glucosidase | 81.08% | 99.00% |
| CHEMBL5939 | Q9NZ08 | Endoplasmic reticulum aminopeptidase 1 | 80.24% | 100.00% |
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.
| Knema laurina |
| PubChem | 163036468 |
| LOTUS | LTS0082180 |
| wikiData | Q105144317 |