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ScientificNameLabel
Z-alpha-bisabolene epoxide
PHCD compound ID : 1502
Chemical Names :
Z-alpha-bisabolene epoxide
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms: 3-[(1Z)-1,5-dimethylhexa-1,4-dienyl]-6-methyl-7-oxabicyclo[4.1.0]heptane , 6-methyl-3-[(2Z)-6-methylhepta-2,5-dien-2-yl]-7-oxabicyclo[4.1.0]heptane
Smiles: CC(=CC/C=C(\[C@@H]1CC[C@@]2([C@H](C1)O2)C)/C)C
InChi : InChI=1S/C15H24O/c1-11(2)6-5-7-12(3)13-8-9-15(4)14(10-13)16-15/h6-7,13-14H,5,8-10H2,1-4H3/b12-7-/t13-,14+,15-/m1/s1
InChi Key : InChIKey=BOWJPMUUGHPAAF-VJUFAYPDSA-N
PubChem ID : 5363099
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.955028
Hydrogen bond donor count : 0 Electric dipole moment : 2.104
XLogP : 4.258 VDW volume : 246.80062
Molecular weight : 220.182715 HOMO-LUMO gap : 10.239000
Herb list :
Refrences & Litretures:
  
161.      Journal:'Archives of Applied Science Research'      Year:'2011'      Volume:'3'      Page:'44'      DOI:''      Title:'Biocontrol of Botrytis cinerea with essential oil and methanol extract of Viola odorata L. flowers'
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