15-[5-(2-Hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,10,14-triol
| Internal ID | 478426b7-4e37-4b88-8c2b-3f1397374d2b |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Terpene glycosides > Triterpene glycosides > Triterpene saponins |
| IUPAC Name | 15-[5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,10,14-triol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C30H50O5/c1-24(2)19-14-17(31)23-27(6)15-18(32)22(28(7)10-9-21(35-28)25(3,4)34)26(27,5)12-13-30(23)16-29(19,30)11-8-20(24)33/h17-23,31-34H,8-16H2,1-7H3 |
| InChI Key | GZMYDRXMKKTTGL-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C30H50O5 |
| Molecular Weight | 490.70 g/mol |
| Exact Mass | 490.36582469 g/mol |
| Topological Polar Surface Area (TPSA) | 90.20 Ų |
| XlogP | 4.40 |
| Oprea1_519194 |
![2D Structure of 15-[5-(2-Hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,10,14-triol](https://plantaedb.com/storage/docs/compounds/2023/11/ea4cbee0-8241-11ee-a2d3-457e349fa5f4.jpg "2D Structure of 15-[5-(2-Hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-6,10,14-triol")
| 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 | 97.32% | 97.25% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.33% | 91.11% |
| CHEMBL204 | P00734 | Thrombin | 94.27% | 96.01% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.74% | 97.09% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 90.81% | 96.95% |
| CHEMBL6136 | O60341 | Lysine-specific histone demethylase 1 | 90.76% | 95.58% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 89.03% | 96.61% |
| CHEMBL1871 | P10275 | Androgen Receptor | 88.46% | 96.43% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 88.02% | 100.00% |
| CHEMBL284 | P27487 | Dipeptidyl peptidase IV | 87.63% | 95.69% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 87.20% | 94.45% |
| CHEMBL259 | P32245 | Melanocortin receptor 4 | 85.96% | 95.38% |
| CHEMBL1163125 | O60885 | Bromodomain-containing protein 4 | 85.89% | 97.31% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 85.27% | 82.69% |
| CHEMBL4303 | P08238 | Heat shock protein HSP 90-beta | 84.69% | 96.77% |
| CHEMBL1977 | P11473 | Vitamin D receptor | 84.63% | 99.43% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 84.35% | 89.00% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 84.13% | 97.79% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 83.46% | 96.09% |
| CHEMBL5888 | Q99558 | Mitogen-activated protein kinase kinase kinase 14 | 83.42% | 100.00% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 82.68% | 95.50% |
| CHEMBL4478 | Q00975 | Voltage-gated N-type calcium channel alpha-1B subunit | 81.77% | 97.14% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.64% | 95.89% |
| CHEMBL4482 | O96013 | Serine/threonine-protein kinase PAK 4 | 80.36% | 95.42% |
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.
| Astragalus alopecurus |
| PubChem | 3133559 |
| LOTUS | LTS0083122 |
| wikiData | Q105024467 |