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(E)-Pinocarveol
PHCD compound ID : 823
Chemical Names :
(E)-Pinocarveol
Molecular Formula : C10H16O1
Molecular Weight : 152.120115
More Details :
Names & Synonyms: (1S,3R,5S)-6,6-dimethyl-2-methylene-norpinan-3-ol , (1S,3R,5S)-6,6-dimethyl-4-methylene-3-bicyclo[3.1.1]heptanol , (1S,3R,5S)-6,6-dimethyl-4-methylidenebicyclo[3.1.1]heptan-3-ol , (1S,3R,5S)-6,6-dimethyl-4-methylidene-bicyclo[3.1.1]heptan-3-ol
Smiles: C=C1[C@H](O)C[C@@H]2C[C@H]1C2(C)C
InChi : InChI=1S/C10H16O/c1-6-8-4-7(5-9(6)11)10(8,2)3/h7-9,11H,1,4-5H2,2-3H3/t7-,8+,9+/m0/s1
InChi Key : InChIKey=LCYXQUJDODZYIJ-DJLDLDEBSA-N
PubChem ID : 1201530
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.908312
Hydrogen bond donor count : 1 Electric dipole moment : 2.156
XLogP : 2.192 VDW volume : 162.957156
Molecular weight : 152.120115 HOMO-LUMO gap : 10.754000
Herb list :
Refrences & Litretures:
  
60.      Journal:'Food Control'      Year:'2008'      Volume:'19'      Page:'681'      DOI:'10.1016/j.foodcont.2007.07.007'      Title:'Antimicrobial activity and chemical composition of Thymus vulgaris, Thymus zygis and Thymus hyemalis essential oils'
72.      Journal:'Industrial Crops and Products'      Year:'2006'      Volume:'24'      Page:'253'      DOI:'10.1016/j.indcrop.2006.06.011'      Title:'Seasonal variation of Thymus hyemalis Lange and Spanish Thymus vulgaris L. essential oils composition'
167.      Journal:'Industrial Crops and Products'      Year:'2010'      Volume:'31'      Page:'203'      DOI:'10.1016/j.indcrop.2009.10.003'      Title:'Antioxidant activities and chemical composition of essential oil of Pistacia atlantica from Algeria'
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