Heptadeca-1,7,9-trien-11,13,15-triyne
Internal ID | 49816fc9-c16b-46b6-9e2f-af3041524e13 |
Taxonomy | Hydrocarbons > Unsaturated hydrocarbons > Enynes |
IUPAC Name | heptadeca-1,7,9-trien-11,13,15-triyne |
SMILES (Canonical) | CC#CC#CC#CC=CC=CCCCCC=C |
SMILES (Isomeric) | CC#CC#CC#CC=CC=CCCCCC=C |
InChI | InChI=1S/C17H18/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3,13,15-17H,1,5,7,9,11H2,2H3 |
InChI Key | LEQCZKIMKYGCIQ-UHFFFAOYSA-N |
Popularity | 0 references in papers |
Molecular Formula | C17H18 |
Molecular Weight | 222.32 g/mol |
Exact Mass | 222.140850574 g/mol |
Topological Polar Surface Area (TPSA) | 0.00 Ų |
XlogP | 5.60 |
There are no found synonyms. |
![2D Structure of Heptadeca-1,7,9-trien-11,13,15-triyne 2D Structure of Heptadeca-1,7,9-trien-11,13,15-triyne](https://plantaedb.com/storage/docs/compounds/2023/11/heptadeca-179-trien-111315-triyne.jpg)
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 |
---|---|---|---|---|
CHEMBL3227 | P41594 | Metabotropic glutamate receptor 5 | 86.87% | 96.42% |
CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 85.39% | 96.09% |
CHEMBL3060 | Q9Y345 | Glycine transporter 2 | 83.83% | 99.17% |
CHEMBL221 | P23219 | Cyclooxygenase-1 | 83.64% | 90.17% |
CHEMBL2581 | P07339 | Cathepsin D | 83.13% | 98.95% |
CHEMBL203 | P00533 | Epidermal growth factor receptor erbB1 | 82.62% | 97.34% |
CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 81.43% | 89.34% |
CHEMBL242 | Q92731 | Estrogen receptor beta | 80.61% | 98.35% |
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.
Artemisia vulgaris |
Artemisia vulgaris subsp. vulgaris |
Centaurea diluta |
Jacobaea vulgaris |
Leucanthemum vulgare subsp. vulgare |
Solidago nemoralis |
PubChem | 72731071 |
LOTUS | LTS0203633 |
wikiData | Q105150728 |