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ScientificNameLabel
cis-allo-ocimene
PHCD compound ID : 2026
Chemical Names :
cis-allo-ocimene
Molecular Formula : C10H16
Molecular Weight : 136.125201
More Details :
Names & Synonyms: (4Z,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-BHJHHZOLSA-N
PubChem ID : 5317469
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.644412
Hydrogen bond donor count : 0 Electric dipole moment : 0.974
XLogP : 4.152 VDW volume : 173.606929
Molecular weight : 136.125201 HOMO-LUMO gap : 9.054000
Herb list :
Refrences & Litretures:
  
239.      Journal:'J. Agric. Food Chem'      Year:'2011'      Volume:'59'      Page:'11367'      DOI:'10.1021/jf202277w'      Title:'Artemisia dracunculus L. (Tarragon): A Critical Review of Its Traditional Use, Chemical Composition, Pharmacology, and Safety'
296.      Journal:'Molecules'      Year:'2010'      Volume:'15'      Page:'233'      DOI:'10.3390/molecules15010233'      Title:'Determination of the Volatile Composition in Essential Oil of Descurainia sophia (L.) Webb ex Prantl (Flixweed) by Gas Chromatography/Mass Spectrometry (GC/MS)'
297.      Journal:'J Food Sci Technol'      Year:'2015'      Volume:'52'      Page:'4450'      DOI:'10.1007/s13197-014-1353-3'      Title:'Optimization of supercritical fluid extraction of essential oils and fatty acids from flixweed (Descurainia Sophia L.) seed using response surface methodology and central composite design'
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