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Icosapentaenoic acid
PHCD compound ID : 2668
Chemical Names :
Eicosapentaenoic acid , Icosapentaenoic acid
Molecular Formula : C20H30O2
Molecular Weight : 302.22458
More Details :
Names & Synonyms: (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid , (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoic acid
Smiles: CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=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/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,13-12-,16-15-
InChi Key : InChIKey=JAZBEHYOTPTENJ-JLNKQSITSA-N
PubChem ID : 446284
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.454050
Hydrogen bond donor count : 1 Electric dipole moment : 1.513
XLogP : 8.022 VDW volume : 356.237852
Molecular weight : 302.22458 HOMO-LUMO gap : 10.321000
Herb list :
Refrences & Litretures:
  
309.      Journal:'BioMed Research International'      Year:'2015'      Volume:''      Page:'925631'      DOI:'10.1155/2015/925631'      Title:'Portulaca oleracea L.: A Review of Phytochemistry and Pharmacological Effects'
532.      Journal:'J PURE APPL MICROBIO'      Year:'2013'      Volume:'7'      Page:'379'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of Ziziphus jujuba Seeds Extract'
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