Rickiol A3
| Internal ID | 73293b2b-d3d8-4a3a-bcf0-7ee21a1e8dee |
| Taxonomy | Phenylpropanoids and polyketides > Macrolides and analogues |
| IUPAC Name | (3E,5S,7S,20S,22R,24R)-5,7,20,22-tetrahydroxy-24-methyl-1-oxacyclotetracos-3-en-2-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C24H44O6/c1-19-16-23(28)18-21(26)13-11-9-7-5-3-2-4-6-8-10-12-20(25)17-22(27)14-15-24(29)30-19/h14-15,19-23,25-28H,2-13,16-18H2,1H3/b15-14+/t19-,20+,21+,22-,23+/m1/s1 |
| InChI Key | ZRNPXUOBYDVONQ-NSBGNKJSSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C24H44O6 |
| Molecular Weight | 428.60 g/mol |
| Exact Mass | 428.31378912 g/mol |
| Topological Polar Surface Area (TPSA) | 107.00 Ų |
| XlogP | 5.00 |
| RefChem:179407 |
| CHEBI:214951 |
| (3E,5S,7S,20S,22R,24R)-5,7,20,22-tetrahydroxy-24-methyl-1-oxacyclotetracos-3-en-2-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 |
|---|---|---|---|---|
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 91.97% | 97.25% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 89.40% | 95.56% |
| CHEMBL2581 | P07339 | Cathepsin D | 88.26% | 98.95% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 87.12% | 97.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 86.64% | 91.11% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.24% | 95.89% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 85.58% | 96.09% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 84.84% | 100.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 83.71% | 99.23% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.75% | 90.71% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 82.61% | 89.00% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 82.04% | 93.04% |
| CHEMBL3012 | Q13946 | Phosphodiesterase 7A | 81.31% | 99.29% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 80.05% | 86.00% |
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.
| Annona muricata |
| PubChem | 146683944 |
| LOTUS | LTS0041183 |
| wikiData | Q105153899 |