(1aS,6R,7R,7aS,7bS)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulen-6-ol
| Internal ID | 7e82cd69-9de0-4d9b-88e5-f94e0b0fc0ad |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Sesquiterpenoids > Aromadendrane sesquiterpenoids > 5,10-cycloaromadendrane sesquiterpenoids |
| IUPAC Name | (1aS,6R,7R,7aS,7bS)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulen-6-ol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C15H24O/c1-8-5-6-11-14(15(11,3)4)13-9(2)12(16)7-10(8)13/h9,11-14,16H,5-7H2,1-4H3/t9-,11-,12+,13-,14-/m0/s1 |
| InChI Key | IZONCCDNUJQVJH-HNGSFYKJSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C15H24O |
| Molecular Weight | 220.35 g/mol |
| Exact Mass | 220.182715385 g/mol |
| Topological Polar Surface Area (TPSA) | 20.20 Ų |
| XlogP | 2.90 |
| There are no found synonyms. |
![2D Structure of (1aS,6R,7R,7aS,7bS)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulen-6-ol](https://plantaedb.com/storage/docs/compounds/2023/11/1as6r7r7as7bs-1147-tetramethyl-1a235677a7b-octahydrocyclopropaeazulen-6-ol.jpg "2D Structure of (1aS,6R,7R,7aS,7bS)-1,1,4,7-tetramethyl-1a,2,3,5,6,7,7a,7b-octahydrocyclopropa[e]azulen-6-ol")
| 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 |
|---|---|---|---|---|
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 92.00% | 92.94% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 91.21% | 96.09% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 89.02% | 100.00% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 88.84% | 97.09% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 87.60% | 97.79% |
| CHEMBL1871 | P10275 | Androgen Receptor | 87.54% | 96.43% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 86.50% | 95.89% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 86.17% | 90.17% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 85.89% | 91.11% |
| CHEMBL4681 | P42330 | Aldo-keto-reductase family 1 member C3 | 84.00% | 89.05% |
| CHEMBL325 | Q13547 | Histone deacetylase 1 | 80.65% | 95.92% |
| CHEMBL4803 | P29474 | Nitric-oxide synthase, endothelial | 80.59% | 86.00% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 80.40% | 86.33% |
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.
| Calypogeia muelleriana |
| PubChem | 100927812 |
| LOTUS | LTS0052621 |
| wikiData | Q105123346 |