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ScientificNameLabel
cis-piperitone oxide
PHCD compound ID : 1925
Chemical Names :
Piperitone epoxide cis , cis-piperitone oxide , cis-Piperitone epoxide
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms: (1S,3S,6S)-3-isopropyl-6-methyl-7-oxabicyclo[4.1.0]heptan-2-one , (1S,3S,6S)-6-methyl-3-propan-2-yl-7-oxabicyclo[4.1.0]heptan-2-one
Smiles: CC([C@@H]1CC[C@]2([C@@H](C1=O)O2)C)C
InChi : InChI=1S/C10H16O2/c1-6(2)7-4-5-10(3)9(12-10)8(7)11/h6-7,9H,4-5H2,1-3H3/t7-,9+,10-/m0/s1
InChi Key : InChIKey=IAFONZHDZMCORS-SFGNSQDASA-N
PubChem ID : 6430796
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.870413
Hydrogen bond donor count : 0 Electric dipole moment : 3.897
XLogP : 1.72 VDW volume : 171.747382
Molecular weight : 168.11503 HOMO-LUMO gap : 10.342000
Herb list :
Refrences & Litretures:
  
228.      Journal:'Food Research International'      Year:'2012'      Volume:'45'      Page:'313'      DOI:'10.1016/j.foodres.2011.09.004'      Title:'Evaluation of the chemical composition and antimicrobial activity of Mentha pulegium, Juniperus phoenicea, and Cyperus longus essential oils from Morocco'
428.      Journal:'World Appl. Sci. J'      Year:'2009'      Volume:'7'      Page:'124'      DOI:''      Title:'Volatile Composition of Ruta graveolens L. of North of Iran'
525.      Journal:'J. Chem. Pharm. Res'      Year:'2010'      Volume:'2'      Page:'284'      DOI:''      Title:'Essential oil composition of Hypericum perforatum L. and Hypericum scabrum L. growing wild in Tajikistan'
659.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'37'      Page:'479'      DOI:'10.1016/j.indcrop.2011.07.024'      Title:'Chemical composition and antioxidant and antimicrobial activity of essential oil of Artemisia annua L. from Bosnia'
678.      Journal:'Molecules'      Year:'2013'      Volume:'18'      Page:'14948'      DOI:'10.3390/molecules181214948'      Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
823.      Journal:'Asian J Pharm Clin Res'      Year:'2019'      Volume:'12'      Page:'124'      DOI:'10.22159/ajpcr.2019.v12i1.28418'      Title:'BIOACTIVITIES AND CHEMOPROFILING COMPARISONS OF CHENOPODIUM AMBROSIOIDES L. AND CHENOPODIUM BOTRYS L. GROWING IN KASHMIR, INDIA'
826.      Journal:'Jeobp'      Year:'2007'      Volume:'10'      Page:'314'      DOI:''      Title:'Essential Oil Composition of Chenopodium botrys L. from Iran'
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