Dec-8-en-4,6-diynyl acetate

Details

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Internal ID c3edb62d-e8be-439d-8906-733a3029a5d1
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty alcohol esters
IUPAC Name dec-8-en-4,6-diynyl acetate
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C12H14O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h3-4H,9-11H2,1-2H3
InChI Key POFUIXIUNQEQNM-UHFFFAOYSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C12H14O2
Molecular Weight 190.24 g/mol
Exact Mass 190.099379685 g/mol
Topological Polar Surface Area (TPSA) 26.30 Ų
XlogP 2.60

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of Dec-8-en-4,6-diynyl acetate

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 95.28% 96.09%
CHEMBL3060 Q9Y345 Glycine transporter 2 90.81% 99.17%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 89.10% 94.45%
CHEMBL2581 P07339 Cathepsin D 86.36% 98.95%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 83.28% 96.00%

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.
Leucanthemum maximum

Cross-Links

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PubChem 162924722
LOTUS LTS0080836
wikiData Q105212379