(6S,7Z,10R,14R)-14-[(6R,8S)-6,8-dihydroxy-2-methylidenenonyl]-6,10-dihydroxy-8-methyl-12-methylidene-1-oxacyclotetradec-7-en-2-one
| Internal ID | 83abcd49-5409-48ab-95d1-03037bd97e46 |
| Taxonomy | Phenylpropanoids and polyketides > Macrolides and analogues |
| IUPAC Name | (6S,7Z,10R,14R)-14-[(6R,8S)-6,8-dihydroxy-2-methylidenenonyl]-6,10-dihydroxy-8-methyl-12-methylidene-1-oxacyclotetradec-7-en-2-one |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C25H42O6/c1-17(7-5-8-22(28)16-20(4)26)14-24-15-19(3)13-23(29)12-18(2)11-21(27)9-6-10-25(30)31-24/h11,20-24,26-29H,1,3,5-10,12-16H2,2,4H3/b18-11-/t20-,21-,22+,23-,24+/m0/s1 |
| InChI Key | ZDRUEHAANPCQTG-YOXVGSKDSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C25H42O6 |
| Molecular Weight | 438.60 g/mol |
| Exact Mass | 438.29813906 g/mol |
| Topological Polar Surface Area (TPSA) | 107.00 Ų |
| XlogP | 3.00 |
| There are no found synonyms. |
![2D Structure of (6S,7Z,10R,14R)-14-[(6R,8S)-6,8-dihydroxy-2-methylidenenonyl]-6,10-dihydroxy-8-methyl-12-methylidene-1-oxacyclotetradec-7-en-2-one](https://plantaedb.com/storage/docs/compounds/2023/11/ab19aad0-866e-11ee-828d-dfdf0dbc96c0.jpg "2D Structure of (6S,7Z,10R,14R)-14-[(6R,8S)-6,8-dihydroxy-2-methylidenenonyl]-6,10-dihydroxy-8-methyl-12-methylidene-1-oxacyclotetradec-7-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 |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 98.89% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.47% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.46% | 95.56% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 93.23% | 91.11% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 90.90% | 97.25% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 90.13% | 93.56% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 90.03% | 90.71% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 88.08% | 94.73% |
| CHEMBL1907600 | Q00535 | Cyclin-dependent kinase 5/CDK5 activator 1 | 87.45% | 93.03% |
| CHEMBL3130 | O00329 | PI3-kinase p110-delta subunit | 87.30% | 96.47% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.54% | 95.89% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 85.83% | 97.09% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 85.61% | 90.08% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 84.75% | 97.79% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 83.42% | 100.00% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 82.13% | 86.00% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 82.05% | 89.00% |
| CHEMBL4227 | P25090 | Lipoxin A4 receptor | 81.58% | 100.00% |
| CHEMBL4581 | P52732 | Kinesin-like protein 1 | 81.38% | 93.18% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 81.15% | 99.23% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 81.11% | 91.49% |
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 | 162982284 |
| LOTUS | LTS0212637 |
| wikiData | Q105372649 |