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7,10,13-Hexadecatrienoic acid
PHCD compound ID : 2566
Chemical Names :
7,10,13-Hexadecatrienoic acid , 7-10-13-Hexadecatrienoic acid
Molecular Formula : C16H26O2
Molecular Weight : 250.19328
More Details :
Names & Synonyms: hexadeca-7,10,13-trienoic acid
Smiles: CC/C=C/C/C=C/C/C=C/CCCCCC(=O)O
InChi : InChI=1S/C16H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h3-4,6-7,9-10H,2,5,8,11-15H2,1H3,(H,17,18)/b4-3+,7-6+,10-9+
InChi Key : InChIKey=KBGYPXOSNDMZRV-IUQGRGSQSA-N
PubChem ID : 2826712
Rotatable bond count : 11 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.602312
Hydrogen bond donor count : 1 Electric dipole moment : 2.027
XLogP : 6.4 VDW volume : 292.326831
Molecular weight : 250.19328 HOMO-LUMO gap : 10.501000
Herb list :
Refrences & Litretures:
  
298.      Journal:'Analytical Chemistry Letters'      Year:'2012'      Volume:'2'      Page:'363'      DOI:'10.1080/22297928.2012.10662621'      Title:'Chemical Composition of Fatty Acid from Different Parts of Descurainia Sophia L. Growing Wild in North of Iran'
713.      Journal:'Trends in Phramaceutical Sciences'      Year:'2016'      Volume:'2'      Page:'77'      DOI:''      Title:'Phytochemical assessments of Astragalus hamosus pods (Iklil-ul-Malik)'
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