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ScientificNameLabel
Eicosanoic acid,ethyl ester
PHCD compound ID : 5463
Chemical Names :
Eicosanoic acid,ethyl ester
Molecular Formula : C22H44O2
Molecular Weight : 340.334131
More Details :
Names & Synonyms: ethyl icosanoate , eicosanoic acid ethyl ester , arachidic acid ethyl ester
Smiles: CCCCCCCCCCCCCCCCCCCC(=O)OCC
InChi : InChI=1S/C22H44O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-4-2/h3-21H2,1-2H3
InChi Key : InChIKey=YBKSMWBLSBAFBQ-UHFFFAOYSA-N
PubChem ID : 29009
Rotatable bond count : 20 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.695378
Hydrogen bond donor count : 0 Electric dipole moment : 1.995
XLogP : 10.59 VDW volume : 404.012115
Molecular weight : 340.334131 HOMO-LUMO gap : 11.885000
Herb list :
Refrences & Litretures:
  
909.      Journal:'Adv Pharm Bull'      Year:'2016'      Volume:'6'      Page:'163'      DOI:'10.15171/apb.2016.023'      Title:'Essential Oil from Flowers and Leaves of Elaeagnus Angustifolia (Elaeagnaceae): Composition, Radical Scavenging and General Toxicity Activities'
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