Skip Navigation Links
ScientificNameLabel
Linolenic acid,ethyl ester
PHCD compound ID : 504
Chemical Names :
9.12.15-Octadecatrienoic acid,ethyl ester. (Z.Z.Z)- , Linolenic acid,ethyl ester
Molecular Formula : C20H34O2
Molecular Weight : 306.25588
More Details :
Names & Synonyms: ethyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate , (9Z,12Z,15Z)-octadeca-9,12,15-trienoic acid ethyl ester
Smiles: CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OCC
InChi : InChI=1S/C20H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h5-6,8-9,11-12H,3-4,7,10,13-19H2,1-2H3/b6-5-,9-8-,12-11-
InChi Key : InChIKey=JYYFMIOPGOFNPK-AGRJPVHOSA-N
PubChem ID : 5367460
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.347820
Hydrogen bond donor count : 0 Electric dipole moment : 2.245
XLogP : 8.282 VDW volume : 361.51077
Molecular weight : 306.25588 HOMO-LUMO gap : 10.488000
Herb list :
Refrences & Litretures:
  
30.      Journal:'Phytochemistry'      Year:'2005'      Volume:'66'      Page:'507'      DOI:'10.1016/j.phytochem.2005.01.007'      Title:'Identi?cation of an EcoRI restriction site for a rapid and precise determination of ?-asarone-free Acorus calamus cytotypes'
377.      Journal:'Pharmaceutical Biology'      Year:'2011'      Volume:'49'      Page:'756'      DOI:'10.3109/13880209.2010.547206'      Title:'Chemical constituents and bioactivities of the liposoluble fraction from different medicinal parts of Crocus sativus'
836.      Journal:'International Journal of ChemTech Research'      Year:'2010'      Volume:'2'      Page:'149'      DOI:''      Title:'Chemical Constituents of hydro alcoholic extract and Phenolic fraction of Cynodon dactylon'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us