[2,4,7,14-Tetraacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-8-yl] butanoate
| Internal ID | 528528f2-972c-44ee-8382-6830db69a79f |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Hexacarboxylic acids and derivatives |
| IUPAC Name | [2,4,7,14-tetraacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-8-yl] butanoate |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C34H48O13/c1-11-12-25(40)45-30-32(10)28-23(31(8,9)46-21(6)38)13-14-24(42-18(3)35)33(28,16-41-32)29(44-20(5)37)26-27(43-19(4)36)17(2)15-34(26,30)47-22(7)39/h13-14,17,23-24,26-30H,11-12,15-16H2,1-10H3 |
| InChI Key | ZCBVOUWYUJHFRP-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C34H48O13 |
| Molecular Weight | 664.70 g/mol |
| Exact Mass | 664.30949158 g/mol |
| Topological Polar Surface Area (TPSA) | 167.00 Ų |
| XlogP | 2.80 |
| There are no found synonyms. |
![2D Structure of [2,4,7,14-Tetraacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-8-yl] butanoate](https://plantaedb.com/storage/docs/compounds/2023/11/dcca7570-85dd-11ee-ac83-cff122debcdb.jpg "2D Structure of [2,4,7,14-Tetraacetyloxy-11-(2-acetyloxypropan-2-yl)-5,9-dimethyl-16-oxatetracyclo[7.5.2.01,10.03,7]hexadec-12-en-8-yl] butanoate")
| 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 |
|---|---|---|---|---|
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 98.87% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.26% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 97.62% | 91.11% |
| CHEMBL2581 | P07339 | Cathepsin D | 97.01% | 98.95% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 94.78% | 97.79% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 91.61% | 86.33% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.89% | 94.45% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 87.35% | 96.77% |
| CHEMBL2111367 | P27986 | PI3-kinase p110-alpha/p85-alpha | 86.59% | 94.33% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 86.42% | 89.34% |
| CHEMBL1293316 | Q9HBX9 | Relaxin receptor 1 | 84.96% | 82.50% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 84.30% | 85.14% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 83.65% | 89.00% |
| CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 83.62% | 95.71% |
| CHEMBL340 | P08684 | Cytochrome P450 3A4 | 83.51% | 91.19% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 82.76% | 92.50% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 82.36% | 100.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 82.34% | 99.23% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 82.33% | 97.09% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 82.12% | 97.14% |
| CHEMBL4681 | P42330 | Aldo-keto-reductase family 1 member C3 | 82.07% | 89.05% |
| CHEMBL4662 | P28074 | Proteasome Macropain subunit MB1 | 82.04% | 93.85% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 81.80% | 99.17% |
| CHEMBL2413 | P32246 | C-C chemokine receptor type 1 | 80.86% | 89.50% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 80.84% | 100.00% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 80.41% | 100.00% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 80.15% | 93.56% |
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.
| Euphorbia kopetdaghi |
| PubChem | 75303035 |
| LOTUS | LTS0023861 |
| wikiData | Q105370967 |