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ScientificNameLabel
Isophytol
PHCD compound ID : 1215
Chemical Names :
Isophytol
Molecular Formula : C20H40O1
Molecular Weight : 296.307916
More Details :
Names & Synonyms: 3,7,11,15-tetramethylhexadec-1-en-3-ol , 3,7,11,15-tetramethyl-1-hexadecen-3-ol
Smiles: C=C[C@@](CCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)(O)C
InChi : InChI=1S/C20H40O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,17-19,21H,1,8-16H2,2-6H3/t18-,19-,20+/m1/s1
InChi Key : InChIKey=KEVYVLWNCKMXJX-AQNXPRMDSA-N
PubChem ID : 10453
Rotatable bond count : 13 Rule of five : 2
Hydrogen bond acceptor count : 1 Ionization potential : 10.009641
Hydrogen bond donor count : 1 Electric dipole moment : 1.813
XLogP : 8.893 VDW volume : 360.629919
Molecular weight : 296.307916 HOMO-LUMO gap : 11.184000
Herb list :
Refrences & Litretures:
  
123.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2015'      Volume:'18'      Page:'1321'      DOI:'10.1080/0972060X.2015.1024445'      Title:'Chemical Composition of Essential Oils from Aerial Parts of Ferula gummosa (Apiaceae) in Jajarm Region, Iran Using Traditional Hydrodistillation and Solvent-Free Microwave Extraction Methods: A Comparative Approach'
136.      Journal:'J. Essent. Oil Res'      Year:'2006'      Volume:'18'      Page:'164'      DOI:'10.1080/10412905.2006.9699055'      Title:'Essential Oil Composition of Lallemantia iberica Fisch. et C.A. Mey'
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'
304.      Journal:'Research Journal of Pharmaceutical, Biological and Chemical Sciences'      Year:'2011'      Volume:'2'      Page:'1136'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil from Sinapis alba L. and Sinapis arvensis L. (Brassicaceae) growing wild in Jordan'
314.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'373'      DOI:'10.1080/0972060X.2012.10644063'      Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Verbascum thapsus L'
395.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2009'      Volume:'12'      Page:'111'      DOI:'10.1080/0972060X.2009.10643700'      Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
397.      Journal:'International Journal of Pharmacology & Toxicology'      Year:'2015'      Volume:'5'      Page:'42'      DOI:''      Title:'CHEMICAL AND ANTIMICROBIAL PROPERTIES OF ESSENTIAL OILS OF Olea europea L'
497.      Journal:'World Appl. Sci. J'      Year:'2014'      Volume:'29'      Page:'171'      DOI:'10.5829/idosi.wasj.2014.29.02.1240'      Title:'Chemical Composition of the Essential Oil from Melilotus officinalis (L.) Pall'
814.      Journal:'Natural Products: An Indian Journal'      Year:'2013'      Volume:'9'      Page:'16'      DOI:''      Title:'Comparison investigation of essential oils in tea (Camellia sinensis L.var. sinensis) clones'
844.      Journal:'Flavour Fragr. J'      Year:'2002'      Volume:'17'      Page:'187'      DOI:'10.1002/ffj.1079'      Title:'Composition of the essential oil from the leaves of Eruca sativa'
857.      Journal:'Journal of Essential Oil Research'      Year:'2009'      Volume:'21'      Page:'127'      DOI:'10.1080/10412905.2009.9700129'      Title:'The Essential Oil Composition of Froriepia subpinnata (Ledeb.) Baill'
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