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ScientificNameLabel
Cuparene
PHCD compound ID : 431
Chemical Names :
Cuparene
Molecular Formula : C15H22
Molecular Weight : 202.172151
More Details :
Names & Synonyms: 1-methyl-4-[(1R)-1,2,2-trimethylcyclopentyl]benzene
Smiles: Cc1ccc(cc1)[C@]1(C)CCCC1(C)C
InChi : InChI=1S/C15H22/c1-12-6-8-13(9-7-12)15(4)11-5-10-14(15,2)3/h6-9H,5,10-11H2,1-4H3/t15-/m0/s1
InChi Key : InChIKey=SLKPBCXNFNIJSV-HNNXBMFYSA-N
PubChem ID : 86895
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.003808
Hydrogen bond donor count : 0 Electric dipole moment : 0.210
XLogP : 6.158 VDW volume : 224.473935
Molecular weight : 202.172151 HOMO-LUMO gap : 9.470000
Herb list :
Refrences & Litretures:
  
26.      Journal:'Molecules'      Year:'2013'      Volume:'18'      Page:'5684'      DOI:'10.3390/molecules18055684'      Title:'Identification of Insecticidal Constituents of the Essential Oil of Acorus calamus Rhizomes against Liposcelis bostrychophila Badonnel'
29.      Journal:'Journal of Essential Oil Research'      Year:'2008'      Volume:'20'      Page:'250'      DOI:''      Title:'Aromas from Quebec. I. Composition of the essential oil of the rhizomes of Acorus calamus L'
54.      Journal:'Research Journal of Pharmacognosy'      Year:'2014'      Volume:'1'      Page:'51'      DOI:''      Title:'Assessment of chemical composition of essential oil of Ferula assa-foetida oleogum-resin from two different sites of Yazd province in center of Iran'
58.      Journal:'Food Chemistry'      Year:'2005'      Volume:'91'      Page:'639'      DOI:'10.1016/j.foodchem.2004.06.033'      Title:'Comparison of essential oils compositions of Ferula assa-foetida obtained by supercritical carbon dioxide extraction and hydrodistillation methods'
96.      Journal:'Industrial Crops and Products'      Year:'2011'      Volume:'34'      Page:'1482'      DOI:'10.1016/j.indcrop.2011.05.005'      Title:'Sesquiterpenic composition of the in?orescences of Brazilian chamomile (Matricaria recutita L.): Impact of the agricultural practices'
126.      Journal:'Chemistry of Natural Compounds'      Year:'2005'      Volume:'41'      Page:'311'      DOI:''      Title:'Ferula gummosa FRUITS: AN AROMATIC ANTIMICROBIAL AGENT'
164.      Journal:'J Food Sci Technol'      Year:'2015'      Volume:'52'      Page:'6784'      DOI:'10.1007/s13197-015-1789-0'      Title:'Chemical composition, antioxidant and antibacterial properties of Bene (Pistacia atlantica subsp. mutica) hull essential oil'
214.      Journal:'Flavour Fragr. J'      Year:'2002'      Volume:'17'      Page:'272'      DOI:'10.1002/ffj.1096'      Title:'Volatile constituents of Cymbopogon olivieri (Boiss.) Bor from Iran'
306.      Journal:'Int. J. Biol. Chem'      Year:'2010'      Volume:'4'      Page:'190'      DOI:'10.3923/ijbc.2010.190.202'      Title:'Screening of Chemical Analysis, Antioxidant Antimicrobial and Antitumor Activities of Essential Oil of Oleander (Nerium oleander) Flower'
536.      Journal:'Journal of Analytical Methods in Chemistry'      Year:'2013'      Volume:''      Page:'246986'      DOI:'10.1155/2013/246986'      Title:'Comparative Analysis of the Volatile Components of Agrimonia eupatoria from Leaves and Roots by Gas Chromatography-Mass Spectrometry and Multivariate Curve Resolution'
541.      Journal:'Journal of Essential Oil Research'      Year:'2005'      Volume:'17'      Page:'153'      DOI:'10.1080/10412905.2005.9698862'      Title:'Studies on Essential Oil Composition of Cultivars of Black Pepper (Piper nigrum L.)—V'
745.      Journal:'J. Serb. Chem. Soc'      Year:'2011'      Volume:'76'      Page:'857'      DOI:'10.2298/JSC100830074Y'      Title:'Composition and in vitro antimicrobial activity of the essential oil of Dorema ammoniacum D. Don. fruit from Iran'
754.      Journal:'Advanced Herbal Medicine'      Year:'2015'      Volume:'1'      Page:'21'      DOI:''      Title:'The essential oil composition of wild celery (Kelussia odoratissima Mozaff.): An Iranian endemic plant'
755.      Journal:'Experimental Parasitology'      Year:'2012'      Volume:'132'      Page:'470'      DOI:'org/10.1016/j.exppara.2012.09.010'      Title:'Identification of chemical constituents and larvicidal activity of Kelussia odoratissima Mozaffarian essential oil against two mosquito vectors Anopheles stephensi and Culex pipiens (Diptera: Culicidae)'
756.      Journal:'Journal of Herbs, Spices & Medicinal Plants'      Year:'2011'      Volume:'17'      Page:'62'      DOI:'10.1080/10496475.2011.560089'      Title:'Chemical Composition of Three Ecotypes of Wild Celery (Kelussia odoratissima)'
757.      Journal:'CLINICS'      Year:'2011'      Volume:'66'      Page:'843'      DOI:'10.1590/S1807-59322011000500022'      Title:'Chemical composition of the essential oil from Kelussia odoratissima Mozaff. and the evaluation of its sedative and anxiolytic effects in mice'
758.      Journal:'Chemistry of Natural Compounds'      Year:'2010'      Volume:'46'      Page:'813'      DOI:'10.1007/s10600-010-9754-7'      Title:'CHEMICAL CHARACTERISTICS OF THE SEED OF IRANIAN ENDEMIC PLANT Kelussia odoratissima'
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