n-Octylcyclopentane
| Internal ID | 74e76762-28ff-4044-b254-4aef5d932a2e |
| Taxonomy | Hydrocarbons > Saturated hydrocarbons > Cycloalkanes |
| IUPAC Name | octylcyclopentane |
| SMILES (Canonical) | CCCCCCCCC1CCCC1 |
| SMILES (Isomeric) | CCCCCCCCC1CCCC1 |
| InChI | InChI=1S/C13H26/c1-2-3-4-5-6-7-10-13-11-8-9-12-13/h13H,2-12H2,1H3 |
| InChI Key | HARXDULSBROLME-UHFFFAOYSA-N |
| Popularity | 9 references in papers |
| Molecular Formula | C13H26 |
| Molecular Weight | 182.35 g/mol |
| Exact Mass | 182.203450829 g/mol |
| Topological Polar Surface Area (TPSA) | 0.00 Ų |
| XlogP | 6.80 |
| octylcyclopentane |
| 1795-20-6 |
| Cyclopentane, octyl- |
| DTXSID00170818 |
| HARXDULSBROLME-UHFFFAOYSA-N |
| 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 |
|---|---|---|---|---|
| CHEMBL4462 | Q8IXJ6 | NAD-dependent deacetylase sirtuin 2 | 98.38% | 90.24% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 97.09% | 97.25% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 96.09% | 89.63% |
| CHEMBL240 | Q12809 | HERG | 94.70% | 89.76% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.02% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 92.89% | 96.09% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 91.68% | 91.81% |
| CHEMBL1968 | P07099 | Epoxide hydrolase 1 | 91.63% | 98.57% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 90.89% | 100.00% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 90.70% | 97.79% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.07% | 97.09% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 89.26% | 95.50% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 88.94% | 93.56% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 88.78% | 92.86% |
| CHEMBL1914 | P06276 | Butyrylcholinesterase | 87.17% | 95.00% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 87.10% | 95.17% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 85.93% | 99.18% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 85.21% | 92.08% |
| CHEMBL4660 | P28907 | Lymphocyte differentiation antigen CD38 | 84.92% | 95.27% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 84.08% | 97.29% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 83.71% | 92.50% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 83.61% | 92.62% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 83.60% | 85.94% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 82.72% | 98.33% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 82.63% | 93.04% |
| CHEMBL237 | P41145 | Kappa opioid receptor | 82.45% | 98.10% |
| CHEMBL2001 | Q9H244 | Purinergic receptor P2Y12 | 80.43% | 96.00% |
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.
| Caryocar coriaceum |
| PubChem | 137210 |
| LOTUS | LTS0203457 |
| wikiData | Q69758033 |