Octa-2,4-dienamide

Details

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Internal ID 1792b532-0553-49d6-9c3f-cad4fcb603d1
Taxonomy Organic acids and derivatives > Carboxylic acids and derivatives > Carboxylic acid derivatives > Primary carboxylic acid amides
IUPAC Name octa-2,4-dienamide
SMILES (Canonical) CCCC=CC=CC(=O)N
SMILES (Isomeric) CCCC=CC=CC(=O)N
InChI InChI=1S/C8H13NO/c1-2-3-4-5-6-7-8(9)10/h4-7H,2-3H2,1H3,(H2,9,10)
InChI Key GSHDXSRSGKTAJL-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C8H13NO
Molecular Weight 139.19 g/mol
Exact Mass 139.099714038 g/mol
Topological Polar Surface Area (TPSA) 43.10 Ų
XlogP 1.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Octa-2,4-dienamide

3D Structure

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ADMET Properties (via admetSAR 2)

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

Targets

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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 92.88% 96.09%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 92.06% 89.34%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 88.50% 96.95%
CHEMBL3060 Q9Y345 Glycine transporter 2 85.49% 99.17%
CHEMBL221 P23219 Cyclooxygenase-1 83.96% 90.17%

Plants that contains it

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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.
Phyllanthus fraternus

Cross-Links

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PubChem 73664437
LOTUS LTS0171260
wikiData Q105017147