Linfuranone C
| Internal ID | fb739337-ebd0-4c5f-81fb-1280cb3676a9 |
| Taxonomy | Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohols > Long-chain fatty alcohols |
| IUPAC Name | 5-[(2R,9R,10R,13R)-2,10-dihydroxy-9,11,13-trimethyl-14-oxooctadeca-5,7,11-trienyl]-2-hydroxy-2,4-dimethylfuran-3-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C27H42O6/c1-7-8-15-23(29)19(3)16-20(4)25(30)18(2)13-11-9-10-12-14-22(28)17-24-21(5)26(31)27(6,32)33-24/h9-11,13,16,18-19,22,25,28,30,32H,7-8,12,14-15,17H2,1-6H3/t18-,19-,22-,25-,27?/m1/s1 |
| InChI Key | UIEPAKOEVRDAJJ-BOGISDRWSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C27H42O6 |
| Molecular Weight | 462.60 g/mol |
| Exact Mass | 462.29813906 g/mol |
| Topological Polar Surface Area (TPSA) | 104.00 Ų |
| XlogP | 4.30 |
| 5-((2R,9R,10R,13R)-2,10-dihydroxy-9,11,13-trimethyl-14-oxooctadeca-5,7,11-trienyl)-2-hydroxy-2,4-dimethylfuran-3-one |
| 5-[(2R,9R,10R,13R)-2,10-dihydroxy-9,11,13-trimethyl-14-oxooctadeca-5,7,11-trienyl]-2-hydroxy-2,4-dimethylfuran-3-one |
| RefChem:153532 |
| CHEBI:209905 |
| 5-[(2R,9R,10R,13R)-2,10-dihydroxy-9,11,13-trimethyl-14-oxooctadeca-5,7,11-trienyl]-2-hydroxy-2,4-dimethyluran-3-one |
| 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 | 98.96% | 98.95% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 94.17% | 91.11% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 93.89% | 99.17% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 92.44% | 93.56% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 92.07% | 99.23% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 89.00% | 90.17% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 87.31% | 95.56% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 87.00% | 97.79% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 86.57% | 96.09% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 86.34% | 85.94% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 85.07% | 89.00% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 84.02% | 96.47% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 82.88% | 94.45% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 82.80% | 100.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 82.25% | 94.73% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 80.68% | 100.00% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
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| There are no matching plants. |
| PubChem | 139590060 |
| LOTUS | LTS0097160 |
| wikiData | Q105273318 |