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ScientificNameLabel
Alpha-Humulen
PHCD compound ID : 849
Chemical Names :
Alpha-Humulen
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (1Z,4Z,8E)-2,6,6,9-tetramethylcycloundeca-1,4,8-triene
Smiles: CC1=CCC(C)(C)C=CCC(=CCC1)C
InChi : InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6-,13-7-,14-10+
InChi Key : InChIKey=FAMPSKZZVDUYOS-HYXCZMNISA-N
PubChem ID : 24798693
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 8.835737
Hydrogen bond donor count : 0 Electric dipole moment : 0.462
XLogP : 5.94 VDW volume : 247.730393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.098000
Herb list :
Refrences & Litretures:
  
66.      Journal:'Food Chemistry'      Year:'2008'      Volume:'109'      Page:'925'      DOI:'10.1016/j.foodchem.2007.12.084'      Title:'Comparison of microwave-assisted hydrodistillation with the traditional hydrodistillation method in the extraction of essential oils from Thymus vulgaris L'
91.      Journal:'Eur. J. Lipid Sci. Technol'      Year:'2008'      Volume:'110'      Page:'448'      DOI:'10.1002/ejlt.200700239'      Title:'Microwave-assisted hydrodistillation of essential oil from Zataria multiflora Boiss'
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