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ScientificNameLabel
nopinone
PHCD compound ID : 1216
Chemical Names :
nopinone , Beta-Pinone
Molecular Formula : C9H14O1
Molecular Weight : 138.104465
More Details :
Names & Synonyms: 6,6-dimethylnorpinan-2-one , 6,6-dimethyl-4-bicyclo[3.1.1]heptanone , 6,6-dimethylbicyclo[3.1.1]heptan-4-one
Smiles: O=C1CC[C@@H]2C[C@H]1C2(C)C
InChi : InChI=1S/C9H14O/c1-9(2)6-3-4-8(10)7(9)5-6/h6-7H,3-5H2,1-2H3/t6-,7-/m1/s1
InChi Key : InChIKey=XZFDKWMYCUEKSS-RNFRBKRXSA-N
PubChem ID : 32735
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.865194
Hydrogen bond donor count : 0 Electric dipole moment : 3.482
XLogP : 1.926 VDW volume : 145.661171
Molecular weight : 138.104465 HOMO-LUMO gap : 10.816000
Herb list :
Refrences & Litretures:
  
124.      Journal:'Research in Pharmaceutical Sciences'      Year:'2008'      Volume:'3'      Page:'41'      DOI:''      Title:'Composition and antimicrobial activity of oleogumresin of Ferula gumosa Bioss. essential oil using Alamar Blue™'
166.      Journal:'Flora'      Year:'2011'      Volume:'206'      Page:'397'      DOI:'10.1016/j.?ora.2010.08.002'      Title:'Inter-population variability of leaf morpho-anatomical and terpenoid patterns of Pistacia atlantica Desf. ssp. atlantica growing along an aridity gradient in Algeria'
405.      Journal:'FLAVOUR AND FRAGRANCE JOURNAL'      Year:'2004'      Volume:'19'      Page:'311'      DOI:'10.1002/ffj.1302'      Title:'Chemical composition of the essential oil of Cuminum cyminum L. from China'
599.      Journal:'Food Sci. Biotechnol'      Year:'2015'      Volume:'24'      Page:'1943'      DOI:'10.1007/s10068-015-0256-z'      Title:'Chemical Composition and in vitro Evaluation of Total Phenolic, Flavonoid, and Antioxidant Properties of Essential Oil and Solvent Extract from the Aerial Parts of Teucrium polium Grown in Tunisia'
815.      Journal:'International Journal of Food Science and Technology'      Year:'2008'      Volume:'43'      Page:'346'      DOI:'10.1111/j.1365-2621.2006.01458.x'      Title:'Essential oil composition of commercial black tea (Camellia sinensis)'
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