Dec-2-en-4,6,8-triynedioic acid

Details

Top
Internal ID a3fe4248-855e-4d53-a344-e60eee7d25c5
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Medium-chain fatty acids
IUPAC Name dec-2-en-4,6,8-triynedioic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C10H4O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h5,7H,(H,11,12)(H,13,14)
InChI Key QWDVMCKBEOAATM-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

Top
Molecular Formula C10H4O4
Molecular Weight 188.14 g/mol
Exact Mass 188.01095860 g/mol
Topological Polar Surface Area (TPSA) 74.60 Ų
XlogP 1.20

Synonyms

Top
There are no found synonyms.

2D Structure

Top
2D Structure of Dec-2-en-4,6,8-triynedioic acid

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
CHEMBL221 P23219 Cyclooxygenase-1 83.91% 90.17%

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.
There are no matching plants.

Cross-Links

Top
PubChem 162890869
LOTUS LTS0136501
wikiData Q104196275