Emeniveol
| Internal ID | afe4809b-dcb6-46e1-990a-ad76e2792797 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids |
| IUPAC Name | (1S,2S,4aS,6S,8aR)-6-(1H-indol-3-ylmethyl)-1,4a-dimethyl-5-methylidene-1-(4-methylpent-3-enyl)-3,4,6,7,8,8a-hexahydro-2H-naphthalen-2-ol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C28H39NO/c1-19(2)9-8-15-28(5)25-13-12-21(20(3)27(25,4)16-14-26(28)30)17-22-18-29-24-11-7-6-10-23(22)24/h6-7,9-11,18,21,25-26,29-30H,3,8,12-17H2,1-2,4-5H3/t21-,25+,26-,27+,28-/m0/s1 |
| InChI Key | MPNUEXKJZLBKEI-ADNQPUJWSA-N |
| Popularity | 3 references in papers |
| Molecular Formula | C28H39NO |
| Molecular Weight | 405.60 g/mol |
| Exact Mass | 405.303164868 g/mol |
| Topological Polar Surface Area (TPSA) | 36.00 Ų |
| XlogP | 7.40 |
| CHEMBL1257247 |
| 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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 99.54% | 91.11% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 96.10% | 94.75% |
| CHEMBL2581 | P07339 | Cathepsin D | 95.17% | 98.95% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 94.53% | 92.62% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 94.37% | 91.49% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 94.17% | 97.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 93.90% | 95.56% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 93.54% | 94.62% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 92.28% | 93.99% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.64% | 96.09% |
| CHEMBL1829 | O15379 | Histone deacetylase 3 | 91.38% | 95.00% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 91.33% | 88.56% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 89.19% | 94.45% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 89.03% | 90.17% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 87.54% | 95.89% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 86.96% | 100.00% |
| CHEMBL2716 | Q8WUI4 | Histone deacetylase 7 | 86.48% | 89.44% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 84.32% | 89.00% |
| CHEMBL2095226 | P05556 | Integrin alpha-5/beta-1 | 84.00% | 96.39% |
| CHEMBL240 | Q12809 | HERG | 83.64% | 89.76% |
| CHEMBL4051 | P13569 | Cystic fibrosis transmembrane conductance regulator | 82.72% | 95.71% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 82.04% | 98.59% |
| CHEMBL2959 | Q08881 | Tyrosine-protein kinase ITK/TSK | 81.58% | 95.00% |
| CHEMBL4145 | Q9UKV0 | Histone deacetylase 9 | 80.92% | 85.49% |
| CHEMBL3830 | Q2M2I8 | Adaptor-associated kinase | 80.45% | 83.10% |
| CHEMBL3430907 | Q96GD4 | Aurora kinase B/Inner centromere protein | 80.16% | 97.50% |
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 | 10894771 |
| LOTUS | LTS0197309 |
| wikiData | Q77488995 |