Icosa-2,4,6,8,10-pentaenoic acid

Details

Top
Internal ID 8e29b62b-39dd-4bd0-a047-3c331b07c46c
Taxonomy Lipids and lipid-like molecules > Fatty Acyls > Fatty acids and conjugates > Long-chain fatty acids
IUPAC Name icosa-2,4,6,8,10-pentaenoic acid
SMILES (Canonical) CCCCCCCCCC=CC=CC=CC=CC=CC(=O)O
SMILES (Isomeric) CCCCCCCCCC=CC=CC=CC=CC=CC(=O)O
InChI InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h10-19H,2-9H2,1H3,(H,21,22)
InChI Key SBHCLVQMTBWHCD-UHFFFAOYSA-N
Popularity 239 references in papers

Physical and Chemical Properties

Top
Molecular Formula C20H30O2
Molecular Weight 302.50 g/mol
Exact Mass 302.224580195 g/mol
Topological Polar Surface Area (TPSA) 37.30 Ų
XlogP 7.40

Synonyms

Top
icosa-2,4,6,8,10-pentaenoic acid
eicosapentenoic acid
DTXSID70865209
AKOS028110000
FT-0698104

2D Structure

Top
2D Structure of Icosa-2,4,6,8,10-pentaenoic 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
CHEMBL3060 Q9Y345 Glycine transporter 2 95.24% 99.17%
CHEMBL4769 O95749 Geranylgeranyl pyrophosphate synthetase 93.00% 92.08%
CHEMBL230 P35354 Cyclooxygenase-2 92.41% 89.63%
CHEMBL221 P23219 Cyclooxygenase-1 91.43% 90.17%
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 88.63% 96.09%
CHEMBL3892 Q99500 Sphingosine 1-phosphate receptor Edg-3 88.53% 97.29%
CHEMBL2581 P07339 Cathepsin D 88.33% 98.95%
CHEMBL4793 Q86TI2 Dipeptidyl peptidase IX 87.97% 96.95%
CHEMBL2955 O95136 Sphingosine 1-phosphate receptor Edg-5 84.83% 92.86%
CHEMBL1781 P11387 DNA topoisomerase I 82.93% 97.00%
CHEMBL2274 Q9H228 Sphingosine 1-phosphate receptor Edg-8 81.28% 100.00%
CHEMBL1293267 Q9HC97 G-protein coupled receptor 35 81.20% 89.34%
CHEMBL3359 P21462 Formyl peptide receptor 1 80.73% 93.56%
CHEMBL2001 Q9H244 Purinergic receptor P2Y12 80.63% 96.00%

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.
Allium sativum
Rhytidiadelphus squarrosus
Ulota crispa

Cross-Links

Top
PubChem 135002
LOTUS LTS0107446
wikiData Q104253551