Hexylcyclohexane
| Internal ID | 94378cb5-7762-4511-b4d9-d021bad346ee |
| Taxonomy | Hydrocarbons > Saturated hydrocarbons > Cycloalkanes |
| IUPAC Name | hexylcyclohexane |
| SMILES (Canonical) | CCCCCCC1CCCCC1 |
| SMILES (Isomeric) | CCCCCCC1CCCCC1 |
| InChI | InChI=1S/C12H24/c1-2-3-4-6-9-12-10-7-5-8-11-12/h12H,2-11H2,1H3 |
| InChI Key | QHWAQXOSHHKCFK-UHFFFAOYSA-N |
| Popularity | 31 references in papers |
| Molecular Formula | C12H24 |
| Molecular Weight | 168.32 g/mol |
| Exact Mass | 168.187800766 g/mol |
| Topological Polar Surface Area (TPSA) | 0.00 Ų |
| XlogP | 6.20 |
| 4292-75-5 |
| n-Hexylcyclohexane |
| Cyclohexane, hexyl- |
| 1-CYCLOHEXYLHEXANE |
| Hexane, 1-cyclohexyl- |
| Cyclohexane, n-hexyl- |
| BNS1DVW87A |
| NSC-95433 |
| 1-Hexylcyclohexane |
| NSC95433 |
| There are more than 10 synonyms. If you wish to see them all click here. |
| 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 | 98.24% | 90.24% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 97.56% | 97.25% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 96.75% | 89.63% |
| CHEMBL2581 | P07339 | Cathepsin D | 94.85% | 98.95% |
| CHEMBL1968 | P07099 | Epoxide hydrolase 1 | 94.55% | 98.57% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 93.72% | 91.81% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 93.05% | 96.09% |
| CHEMBL240 | Q12809 | HERG | 92.07% | 89.76% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 92.03% | 100.00% |
| CHEMBL2996 | Q05655 | Protein kinase C delta | 91.68% | 97.79% |
| CHEMBL4187 | Q99250 | Sodium channel protein type II alpha subunit | 91.10% | 95.50% |
| CHEMBL3359 | P21462 | Formyl peptide receptor 1 | 90.90% | 93.56% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 90.07% | 97.09% |
| CHEMBL335 | P18031 | Protein-tyrosine phosphatase 1B | 89.12% | 95.17% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 88.52% | 92.86% |
| CHEMBL1914 | P06276 | Butyrylcholinesterase | 87.80% | 95.00% |
| CHEMBL4660 | P28907 | Lymphocyte differentiation antigen CD38 | 86.77% | 95.27% |
| CHEMBL2373 | P21730 | C5a anaphylatoxin chemotactic receptor | 86.38% | 92.62% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 85.93% | 99.18% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 85.59% | 85.94% |
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 85.21% | 92.08% |
| CHEMBL5255 | O00206 | Toll-like receptor 4 | 84.45% | 92.50% |
| CHEMBL1795139 | Q8IU80 | Transmembrane protease serine 6 | 83.49% | 98.33% |
| CHEMBL3351 | Q13085 | Acetyl-CoA carboxylase 1 | 82.23% | 93.04% |
| CHEMBL3012 | Q13946 | Phosphodiesterase 7A | 81.60% | 99.29% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 81.26% | 97.29% |
| CHEMBL237 | P41145 | Kappa opioid receptor | 80.95% | 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 | 20283 |
| LOTUS | LTS0154728 |
| wikiData | Q63398940 |