(4E,8E,12E,15E,18E,21E)-tetracosa-4,8,12,15,18,21-hexaenoic acid

Details

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Internal ID ac73640b-e2b8-4d57-885e-b4330ec2f4fc
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Very long-chain fatty acids
IUPAC Name (4E,8E,12E,15E,18E,21E)-tetracosa-4,8,12,15,18,21-hexaenoic acid
SMILES (Canonical)
SMILES (Isomeric)
InChI InChI=1S/C24H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h3-4,6-7,9-10,12-13,16-17,20-21H,2,5,8,11,14-15,18-19,22-23H2,1H3,(H,25,26)/b4-3+,7-6+,10-9+,13-12+,17-16+,21-20+
InChI Key YOWPDSQEIZPPKN-IABXFHTOSA-N
Popularity 2 references in papers

Physical and Chemical Properties

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Molecular Formula C24H36O2
Molecular Weight 356.50 g/mol
Exact Mass 356.271530387 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 6.80

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of (4E,8E,12E,15E,18E,21E)-tetracosa-4,8,12,15,18,21-hexaenoic acid

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 92.11% 96.09%
CHEMBL3060 Q9Y345 Glycine transporter 2 91.98% 99.17%
CHEMBL2581 P07339 Cathepsin D 90.43% 98.95%
CHEMBL221 P23219 Cyclooxygenase-1 87.75% 90.17%
CHEMBL1781 P11387 DNA topoisomerase I 82.71% 97.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 80.80% 86.33%

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.
There are no matching plants.

Cross-Links

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PubChem 21867867
LOTUS LTS0129153
wikiData Q105351578