Panclicin C
| Internal ID | 8022cfb1-b5ef-4dcd-beed-9298cfba77d2 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Alpha amino acids and derivatives > Alpha amino acid esters |
| IUPAC Name | [(2S)-1-[(2S,3S)-3-(8-methylnonyl)-4-oxooxetan-2-yl]nonan-2-yl] 2-formamidoacetate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C25H45NO5/c1-4-5-6-8-12-15-21(30-24(28)18-26-19-27)17-23-22(25(29)31-23)16-13-10-7-9-11-14-20(2)3/h19-23H,4-18H2,1-3H3,(H,26,27)/t21-,22-,23-/m0/s1 |
| InChI Key | SMEWLQMERHEMJK-VABKMULXSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C25H45NO5 |
| Molecular Weight | 439.60 g/mol |
| Exact Mass | 439.32977354 g/mol |
| Topological Polar Surface Area (TPSA) | 81.70 Ų |
| XlogP | 8.00 |
| SCHEMBL6870081 |
| 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 | 99.66% | 89.63% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 95.69% | 97.29% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.08% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.42% | 91.11% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 94.23% | 99.17% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 94.15% | 94.45% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 93.87% | 93.56% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.97% | 96.09% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 92.64% | 98.03% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 92.37% | 89.34% |
| CHEMBL2179 | P04062 | Beta-glucocerebrosidase | 91.31% | 85.31% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 89.80% | 92.86% |
| CHEMBL4072 | P07858 | Cathepsin B | 88.60% | 93.67% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 87.93% | 97.79% |
| CHEMBL1907605 | P24864 | Cyclin-dependent kinase 2/cyclin E1 | 87.57% | 92.88% |
| CHEMBL3392948 | Q9NP59 | Solute carrier family 40 member 1 | 86.74% | 95.00% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 86.58% | 95.17% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 85.88% | 92.50% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 85.02% | 100.00% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 84.97% | 95.56% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 84.69% | 94.73% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 84.66% | 94.33% |
| CHEMBL321 | P14780 | Matrix metalloproteinase 9 | 83.73% | 92.12% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 83.34% | 91.19% |
| CHEMBL5163 | Q9NY46 | Sodium channel protein type III alpha subunit | 83.02% | 96.90% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.88% | 90.71% |
| CHEMBL2514 | O95665 | Neurotensin receptor 2 | 82.67% | 100.00% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 82.31% | 100.00% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 82.16% | 96.47% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 81.22% | 89.00% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 80.93% | 96.00% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 80.84% | 93.31% |
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 | 9824494 |
| LOTUS | LTS0052013 |
| wikiData | Q77518286 |