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9,12,15 Octadecatrienoic
PHCD compound ID : 2244
Chemical Names :
Octadeca-9,12,15-trienoic acid , 9,12,15 Octadecatrienoic , 9,12,15-Octadecatrienoic acid
Molecular Formula : C18H30O2
Molecular Weight : 278.22458
More Details :
Names & Synonyms: octadeca-9,12,15-trienoic acid
Smiles: CC/C=C/C/C=C/C/C=C/CCCCCCCC(=O)O
InChi : InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3+,7-6+,10-9+
InChi Key : InChIKey=DTOSIQBPPRVQHS-IUQGRGSQSA-N
PubChem ID : 860
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.505465
Hydrogen bond donor count : 1 Electric dipole moment : 1.373
XLogP : 7.538 VDW volume : 326.918801
Molecular weight : 278.22458 HOMO-LUMO gap : 10.415000
Herb list :
Refrences & Litretures:
  
262.      Journal:'J Sci Food Agric'      Year:'1997'      Volume:'74'      Page:'421'      DOI:''      Title:'Strawberry Flavour: Analysis and Biosynthesis'
269.      Journal:'Zeitschrift fur Naturforschung C'      Year:'1998'      Volume:'53'      Page:'811'      DOI:''      Title:'Chemical Constituents from Shoots of Hordeum vulgare Infested by the Aphid Schizaphis graminum'
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'
554.      Journal:'J Nat Med'      Year:'2015'      Volume:'69'      Page:'387'      DOI:'10.1007/s11418-015-0905-9'      Title:'Alyssum homolocarpum seeds: phytochemical analysis and effects of the seed oil on neural stem cell proliferation and differentiation'
713.      Journal:'Trends in Phramaceutical Sciences'      Year:'2016'      Volume:'2'      Page:'77'      DOI:''      Title:'Phytochemical assessments of Astragalus hamosus pods (Iklil-ul-Malik)'
854.      Journal:'Research Journal of Pharmacognosy'      Year:'2016'      Volume:'3'      Page:'27'      DOI:''      Title:'Salvia macrosiphon seeds and seed oil: pharmacognostic, anti-inflammatory and analgesic properties'
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