Hepta-4,6-diene

Details

Top
Internal ID 22a9063c-568b-48cd-a3cb-da436dd05a4b
Taxonomy Hydrocarbons > Unsaturated hydrocarbons > Olefins > Acyclic olefins > Alkadienes
IUPAC Name hepta-1,3-diene
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C7H12/c1-3-5-7-6-4-2/h3,5,7H,1,4,6H2,2H3
InChI Key OGQVROWWFUXRST-UHFFFAOYSA-N
Popularity 12 references in papers

Physical and Chemical Properties

Top
Molecular Formula C7H12
Molecular Weight 96.17 g/mol
Exact Mass 96.093900383 g/mol
Topological Polar Surface Area (TPSA) 0.00 Ų
XlogP 3.10

Synonyms

Top
There are no found synonyms.

2D Structure

Top
2D Structure of Hepta-4,6-diene

3D Structure

Top

ADMET Properties (via admetSAR 2)

Top
Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

Top

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
CHEMBL203 P00533 Epidermal growth factor receptor erbB1 80.52% 97.34%

Plants that contains it

Top
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.
Parthenium confertum

Cross-Links

Top
PubChem 137572
LOTUS LTS0165755
wikiData Q105191780