(1S,2S,7S,10S,12R,13R)-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-ol
| Internal ID | 1c40065d-6330-40d6-a6ce-fafe6f10d421 |
| Taxonomy | Lipids and lipid-like molecules > Prenol lipids > Diterpenoids > Aphidicolane and stemodane diterpenoids |
| IUPAC Name | (1S,2S,7S,10S,12R,13R)-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-ol |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C20H34O/c1-17(2)8-5-9-18(3)16(17)7-6-14-12-15-13-20(14,18)11-10-19(15,4)21/h14-16,21H,5-13H2,1-4H3/t14-,15+,16-,18-,19+,20-/m0/s1 |
| InChI Key | ODCPNBCPLWJVQI-AEVHBADWSA-N |
| Popularity | 4 references in papers |
| Molecular Formula | C20H34O |
| Molecular Weight | 290.50 g/mol |
| Exact Mass | 290.260965704 g/mol |
| Topological Polar Surface Area (TPSA) | 20.20 Ų |
| XlogP | 5.80 |
| There are no found synonyms. |
![2D Structure of (1S,2S,7S,10S,12R,13R)-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-ol](https://plantaedb.com/storage/docs/compounds/2023/11/1s2s7s10s12r13r-26613-tetramethyltetracyclo10310110027hexadecan-13-ol.jpg "2D Structure of (1S,2S,7S,10S,12R,13R)-2,6,6,13-tetramethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-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 |
|---|---|---|---|---|
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 96.08% | 91.11% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 96.04% | 97.25% |
| CHEMBL240 | Q12809 | HERG | 92.13% | 89.76% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.07% | 96.09% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 91.76% | 97.09% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 91.20% | 94.75% |
| CHEMBL4026 | P40763 | Signal transducer and activator of transcription 3 | 90.27% | 82.69% |
| CHEMBL241 | Q14432 | Phosphodiesterase 3A | 90.14% | 92.94% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 88.52% | 93.99% |
| CHEMBL206 | P03372 | Estrogen receptor alpha | 88.18% | 97.64% |
| CHEMBL233 | P35372 | Mu opioid receptor | 87.18% | 97.93% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 87.14% | 96.95% |
| CHEMBL1994 | P08235 | Mineralocorticoid receptor | 85.05% | 100.00% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 83.33% | 95.50% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 81.45% | 95.89% |
| CHEMBL2041 | P07949 | Tyrosine-protein kinase receptor RET | 81.31% | 91.79% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 81.14% | 95.56% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 80.86% | 90.08% |
| CHEMBL301 | P24941 | Cyclin-dependent kinase 2 | 80.79% | 91.23% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 80.70% | 100.00% |
| CHEMBL284 | P27487 | Dipeptidyl peptidase IV | 80.60% | 95.69% |
| CHEMBL1951 | P21397 | Monoamine oxidase A | 80.57% | 91.49% |
| CHEMBL3012 | Q13946 | Phosphodiesterase 7A | 80.49% | 99.29% |
| CHEMBL1907601 | P11802 | Cyclin-dependent kinase 4/cyclin D1 | 80.27% | 98.99% |
| CHEMBL259 | P32245 | Melanocortin receptor 4 | 80.15% | 95.38% |
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 | 10924259 |
| LOTUS | LTS0045962 |
| wikiData | Q27110115 |