(6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol
| Internal ID | 5744a0f0-a2f6-4a78-96db-1cb9d0df0892 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Alcohols and polyols > Tertiary alcohols |
| IUPAC Name | (6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol |
| SMILES (Canonical) | CC1CCC2(C(C3CCC2(C1C3)C)(C)C)O |
| SMILES (Isomeric) | C[C@H]1CCC2([C@@]3(C1CC(C2(C)C)CC3)C)O |
| InChI | InChI=1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10-,11?,12?,14-,15?/m0/s1 |
| InChI Key | GGHMUJBZYLPWFD-DUNKBJDJSA-N |
| Popularity | 0 references in papers |
| Molecular Formula | C15H26O |
| Molecular Weight | 222.37 g/mol |
| Exact Mass | 222.198365449 g/mol |
| Topological Polar Surface Area (TPSA) | 20.20 Ų |
| XlogP | 4.10 |
| MFCD14702367 |
| AKOS015897160 |
| C09705 |
![2D Structure of (6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-3-ol](https://plantaedb.com/storage/docs/compounds/2023/11/6s8s-2268-tetramethyltricyclo531038undecan-3-ol.jpg "2D Structure of (6S,8S)-2,2,6,8-tetramethyltricyclo[5.3.1.03,8]undecan-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 | 98.38% | 97.25% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 94.82% | 96.09% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 92.81% | 82.69% |
| CHEMBL206 | P03372 | Estrogen receptor alpha | 88.07% | 97.64% |
| CHEMBL233 | P35372 | Mu opioid receptor | 87.57% | 97.93% |
| CHEMBL238 | Q01959 | Dopamine transporter | 87.04% | 95.88% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 85.38% | 97.09% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 84.34% | 100.00% |
| CHEMBL259 | P32245 | Melanocortin receptor 4 | 82.23% | 95.38% |
| CHEMBL4660 | P28907 | Lymphocyte differentiation antigen CD38 | 80.64% | 95.27% |
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.
| Desmos cochinchinensis |
| Pogostemon cablin |
| Valeriana celtica |
| Valeriana jatamansi |
| Valeriana officinalis |
| PubChem | 442384 |
| LOTUS | LTS0270368 |
| wikiData | Q104667260 |