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ScientificNameLabel
Eudesma-3,7-diene
PHCD compound ID : 2811
Chemical Names :
Eudesma-3,7-diene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (8aR)-6-isopropyl-4,8a-dimethyl-2,4a,5,8-tetrahydro-1H-naphthalene , (8aR)-4,8a-dimethyl-6-propan-2-yl-2,4a,5,8-tetrahydro-1H-naphthalene
Smiles: CC1=CCC[C@]2([C@@H]1CC(=CC2)C(C)C)C
InChi : InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6-7,11,14H,5,8-10H2,1-4H3/t14-,15-/m1/s1
InChi Key : InChIKey=SWCOCRTVQQHGKB-HUUCEWRRSA-N
PubChem ID : 6429221
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.078196
Hydrogen bond donor count : 0 Electric dipole moment : 0.462
XLogP : 5.89 VDW volume : 238.010393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.493000
Herb list :
Refrences & Litretures:
  
340.      Journal:'Food Anal. Methods'      Year:'2014'      Volume:'7'      Page:'1433'      DOI:'10.1007/s12161-013-9767-5'      Title:'Comparative Gas Chromatographic–Mass Spectrometric Evaluation of Hop (Humulus lupulus L.) Essential Oils and Extracts Obtained Using Different Sample Preparation Methods'
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