Hex-3-enal
| Internal ID | 8453f04a-5331-441f-a20e-441f3667b677 |
| Taxonomy | Organic oxygen compounds > Organooxygen compounds > Carbonyl compounds > Aldehydes > Medium-chain aldehydes |
| IUPAC Name | hex-3-enal |
| SMILES (Canonical) | CCC=CCC=O |
| SMILES (Isomeric) | CCC=CCC=O |
| InChI | InChI=1S/C6H10O/c1-2-3-4-5-6-7/h3-4,6H,2,5H2,1H3 |
| InChI Key | GXANMBISFKBPEX-UHFFFAOYSA-N |
| Popularity | 5 references in papers |
| Molecular Formula | C6H10O |
| Molecular Weight | 98.14 g/mol |
| Exact Mass | 98.073164938 g/mol |
| Topological Polar Surface Area (TPSA) | 17.10 Ų |
| XlogP | 1.10 |
| 3-Hexenal, (3Z)- |
| FEMA 3923 |
| AKOS028109080 |
| FT-0605368 |
| Q27109276 |
| 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 |
|---|---|---|---|---|
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 85.83% | 96.09% |
| CHEMBL2581 | P07339 | Cathepsin D | 82.80% | 98.95% |
| CHEMBL1293267 | Q9HC97 | G-protein coupled receptor 35 | 81.61% | 89.34% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 80.46% | 95.56% |
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.
| Arctium lappa |
| Juglans nigra |
| Olea europaea |
| Perilla frutescens |
| Plectranthus glabratus |
| PubChem | 23234 |
| LOTUS | LTS0027368 |
| wikiData | Q27109276 |