Bicyclo[2.2.1]heptane-7-methanol, 2-hydroxy-1,7-dimethyl-
| Internal ID | 98d4dbb1-c452-44e5-b6c0-0a400f1f578d |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Monoterpenoids > Bicyclic monoterpenoids |
| IUPAC Name | 7-(hydroxymethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-ol |
| SMILES (Canonical) | CC12CCC(C1(C)CO)CC2O |
| SMILES (Isomeric) | CC12CCC(C1(C)CO)CC2O |
| InChI | InChI=1S/C10H18O2/c1-9-4-3-7(5-8(9)12)10(9,2)6-11/h7-8,11-12H,3-6H2,1-2H3 |
| InChI Key | NMQKRFRZSBQYQF-UHFFFAOYSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C10H18O2 |
| Molecular Weight | 170.25 g/mol |
| Exact Mass | 170.130679813 g/mol |
| Topological Polar Surface Area (TPSA) | 40.50 Ų |
| XlogP | 1.50 |
| 54831-21-9 |
| NMQKRFRZSBQYQF-UHFFFAOYSA-N |
| DTXSID301208377 |
| 2-Hydroxy-1,7-dimethylbicyclo[2.2.1]heptane-7-methanol |
| 7-(Hydroxymethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-ol # |
![2D Structure of Bicyclo[2.2.1]heptane-7-methanol, 2-hydroxy-1,7-dimethyl-](https://plantaedb.com/storage/docs/compounds/2023/11/bicyclo221heptane-7-methanol-2-hydroxy-17-dimethyl-.jpg "2D Structure of Bicyclo[2.2.1]heptane-7-methanol, 2-hydroxy-1,7-dimethyl-")
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 95.75% | 96.09% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 91.35% | 97.25% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.84% | 97.09% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 86.29% | 95.93% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 86.14% | 82.69% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 84.89% | 97.79% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 84.82% | 91.11% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 83.71% | 100.00% |
| CHEMBL299 | P17252 | Protein kinase C alpha | 82.69% | 98.03% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 82.23% | 95.50% |
| CHEMBL206 | P03372 | Estrogen receptor alpha | 81.67% | 97.64% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 80.83% | 95.89% |
| CHEMBL218 | P21554 | Cannabinoid CB1 receptor | 80.62% | 96.61% |
| CHEMBL4681 | P42330 | Aldo-keto-reductase family 1 member C3 | 80.49% | 89.05% |
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.
| Ferula sinaica |
| Ichthyothere terminalis |
| PubChem | 565696 |
| LOTUS | LTS0224196 |
| wikiData | Q105181918 |