3-Methyl-5-(2,4,4-trimethylbicyclo[3.1.0]hex-2-en-3-yl)pent-1-en-3-ol
| Internal ID | 70172b0a-0dca-4e95-85a4-57201a4a6ac2 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Tertiary alcohols |
| IUPAC Name | 3-methyl-5-(2,4,4-trimethyl-3-bicyclo[3.1.0]hex-2-enyl)pent-1-en-3-ol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C15H24O/c1-6-15(5,16)8-7-12-10(2)11-9-13(11)14(12,3)4/h6,11,13,16H,1,7-9H2,2-5H3 |
| InChI Key | WFLJLXHLEAJNDE-UHFFFAOYSA-N |
| Popularity | 0 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 |
| 79373-33-4 |
![2D Structure of 3-Methyl-5-(2,4,4-trimethylbicyclo[3.1.0]hex-2-en-3-yl)pent-1-en-3-ol](https://plantaedb.com/storage/docs/compounds/2023/11/3-methyl-5-244-trimethyl-3-bicyclo310hex-2-enylpent-1-en-3-ol.jpg "2D Structure of 3-Methyl-5-(2,4,4-trimethylbicyclo[3.1.0]hex-2-en-3-yl)pent-1-en-3-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 |
|---|---|---|---|---|
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 98.36% | 97.25% |
| CHEMBL206 | P03372 | Estrogen receptor alpha | 95.82% | 97.64% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.13% | 96.09% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 91.70% | 91.11% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.57% | 97.09% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 90.96% | 90.93% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 88.89% | 97.79% |
| CHEMBL240 | Q12809 | HERG | 87.92% | 89.76% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 87.21% | 96.95% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 82.85% | 100.00% |
| CHEMBL6136 | O60341 | Lysine-specific histone demethylase 1 | 82.58% | 95.58% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 81.15% | 96.61% |
| CHEMBL3230 | O95977 | Sphingosine 1-phosphate receptor Edg-6 | 80.12% | 94.01% |
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 | 23427017 |
| LOTUS | LTS0168479 |
| wikiData | Q105304009 |