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ScientificNameLabel
neo-allo-Ocimene
PHCD compound ID : 791
Chemical Names :
neo-allo-Ocimene
Molecular Formula : C10H16
Molecular Weight : 136.125201
More Details :
Names & Synonyms: (4E,6Z)-2,6-dimethylocta-2,4,6-triene
Smiles: C/C=C(\C=C\C=C(C)C)/C
InChi : InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5-8H,1-4H3/b8-6+,10-5-
InChi Key : InChIKey=GQVMHMFBVWSSPF-DAIHKBMKSA-N
PubChem ID : 5371125
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.548067
Hydrogen bond donor count : 0 Electric dipole moment : 1.163
XLogP : 4.152 VDW volume : 173.606929
Molecular weight : 136.125201 HOMO-LUMO gap : 8.823000
Herb list :
Refrences & Litretures:
  
55.      Journal:'Food Chemistry'      Year:'2013'      Volume:'138'      Page:'2180'      DOI:'10.1016/j.foodchem.2012.11.131'      Title:'Chemical composition, antioxidant and antimicrobial activities of essential oil obtained from Ferula assa-foetida oleo-gum-resin: Effect of collection time'
57.      Journal:'Intl. Res. J. Appl. Basic. Sci'      Year:'2012'      Volume:'3'      Page:'919'      DOI:''      Title:'Bitter and Sweet Ferula assa-foetida L. Essential oil Composition from Iran and its Comparison with Ferula assa-foetida L. used in India'
214.      Journal:'Flavour Fragr. J'      Year:'2002'      Volume:'17'      Page:'272'      DOI:'10.1002/ffj.1096'      Title:'Volatile constituents of Cymbopogon olivieri (Boiss.) Bor from Iran'
487.      Journal:'Fitoterapia'      Year:'2010'      Volume:'81'      Page:'413'      DOI:'10.1016/j.?tote.2009.11.010'      Title:'Characterization and antimicrobial activity of essential oils of industrial hemp varieties (Cannabis sativa L.)'
677.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2707'      DOI:'10.1002/jsfa.6089'      Title:'Chemical composition and bioactivity of different oregano (Origanum vulgare) extracts and essential oil'
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