Icosapent sodiumProduct ingredient for Icosapent

Name
Icosapent sodium
Drug Entry
Icosapent

Important polyunsaturated fatty acid found in fish oils. It serves as the precursor for the prostaglandin-3 and thromboxane-3 families. A diet rich in eicosapentaenoic acid lowers serum lipid concentration, reduces incidence of cardiovascular disorders, prevents platelet aggregation, and inhibits arachidonic acid conversion into the thromboxane-2 and prostaglandin-2 families.

Accession Number
DBSALT002305
Structure
Synonyms
Not Available
UNII
5PXN91KPRO
CAS Number
73167-03-0
Weight
Average: 324.44
Monoisotopic: 324.20652445
Chemical Formula
C20H29NaO2
InChI Key
RBZYGQJEMWGTOH-RSDXMDNYSA-M
InChI
InChI=1S/C20H30O2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22;/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22);/q;+1/p-1/b4-3-,7-6-,10-9-,13-12-,16-15-;
IUPAC Name
sodium (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
SMILES
[Na+].CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC([O-])=O
ChemSpider
7994441
Predicted Properties
PropertyValueSource
Water Solubility0.000247 mg/mLALOGPS
logP6.49ALOGPS
logP6.23Chemaxon
logS-6.1ALOGPS
pKa (Strongest Acidic)4.82Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area40.13 Å2Chemaxon
Rotatable Bond Count13Chemaxon
Refractivity111.91 m3·mol-1Chemaxon
Polarizability35.35 Å3Chemaxon
Number of Rings0Chemaxon
Bioavailability0Chemaxon
Rule of FiveNoChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon