Heptadecatriene
| Internal ID | 42b304c7-d3dc-4061-b278-fcbd930338d1 |
| Taxonomy | Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkatrienes |
| IUPAC Name | (3E,5E)-heptadeca-1,3,5-triene |
| SMILES (Canonical) | CCCCCCCCCCCC=CC=CC=C |
| SMILES (Isomeric) | CCCCCCCCCCC/C=C/C=C/C=C |
| InChI | InChI=1S/C17H30/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3,5,7,9,11H,1,4,6,8,10,12-17H2,2H3/b7-5+,11-9+ |
| InChI Key | DQKNHNPHGVWPJF-JEGFTUTRSA-N |
| Popularity | 14 references in papers |
| Molecular Formula | C17H30 |
| Molecular Weight | 234.40 g/mol |
| Exact Mass | 234.234750957 g/mol |
| Topological Polar Surface Area (TPSA) | 0.00 Ų |
| XlogP | 8.00 |
| There are no found synonyms. |
| 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 |
|---|---|---|---|---|
| CHEMBL4769 | O95749 | Geranylgeranyl pyrophosphate synthetase | 94.93% | 92.08% |
| CHEMBL230 | P35354 | Cyclooxygenase-2 | 94.09% | 89.63% |
| CHEMBL2955 | O95136 | Sphingosine 1-phosphate receptor Edg-5 | 93.23% | 92.86% |
| CHEMBL3892 | Q99500 | Sphingosine 1-phosphate receptor Edg-3 | 92.65% | 97.29% |
| CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 91.34% | 99.17% |
| CHEMBL2581 | P07339 | Cathepsin D | 89.88% | 98.95% |
| CHEMBL5043 | Q6P179 | Endoplasmic reticulum aminopeptidase 2 | 89.41% | 91.81% |
| CHEMBL240 | Q12809 | HERG | 89.14% | 89.76% |
| CHEMBL2885 | P07451 | Carbonic anhydrase III | 89.03% | 87.45% |
| CHEMBL2265 | P23141 | Acyl coenzyme A:cholesterol acyltransferase | 88.16% | 85.94% |
| CHEMBL1907 | P15144 | Aminopeptidase N | 83.32% | 93.31% |
| CHEMBL4793 | Q86TI2 | Dipeptidyl peptidase IX | 82.59% | 96.95% |
| CHEMBL221 | P23219 | Cyclooxygenase-1 | 81.63% | 90.17% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 80.87% | 96.09% |
| CHEMBL2274 | Q9H228 | Sphingosine 1-phosphate receptor Edg-8 | 80.87% | 100.00% |
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.
| Echinacea purpurea |
| PubChem | 19377911 |
| LOTUS | LTS0071622 |
| wikiData | Q104375644 |