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ScientificNameLabel
Eremophilene
PHCD compound ID : 1344
Chemical Names :
Eremophilene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms: (3R,4aR,5S)-3-isopropenyl-4a,5-dimethyl-2,3,4,5,6,7-hexahydro-1H-naphthalene , (3R,4aR,5S)-4a,5-dimethyl-3-(1-methylethenyl)-2,3,4,5,6,7-hexahydro-1H-naphthalene , (3R,4aR,5S)-4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5,6,7-hexahydro-1H-naphthalene
Smiles: CC(=C)[C@@H]1CCC2=CCC[C@@H]([C@]2(C1)C)C
InChi : InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13+,15+/m0/s1
InChi Key : InChIKey=QEBNYNLSCGVZOH-GZBFAFLISA-N
PubChem ID : 12309744
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.132405
Hydrogen bond donor count : 0 Electric dipole moment : 0.596
XLogP : 5.846 VDW volume : 238.010393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.412000
Herb list :
Refrences & Litretures:
  
143.      Journal:'Journal of Stored Products Research'      Year:'2012'      Volume:'48'      Page:'97'      DOI:'10.1016/j.jspr.2011.10.003'      Title:'Insecticidal activities of essential oils from leaves of Laurus nobilis L. from Tunisia, Algeria and Morocco, and comparative chemical composition'
144.      Journal:'Tunisian Journal of Plant Protection'      Year:'2011'      Volume:'6'      Page:'29'      DOI:''      Title:'Composition and Repellent Efficacy of Essential Oil from Laurus nobilis against Adults of the Cigarette Beetle Lasioderma serricorne (Coleoptera: Anobiidae)'
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'
385.      Journal:'Eur J Clin Microbiol Infect Dis'      Year:'2012'      Volume:'31'      Page:'1015'      DOI:'10.1007/s10096-011-1400-1'      Title:'Antistaphylococcal activity of Inula helenium L. root essential oil: eudesmane sesquiterpene lactones induce cell membrane damage'
452.      Journal:'J. Agric. Food Chem'      Year:'2004'      Volume:'52'      Page:'3915'      DOI:'10.1021/jf0353990'      Title:'Essential Oil of Valeriana officinalis L. Cultivars and Their Antimicrobial Activity As Influenced by Harvesting Time under Commercial Organic Cultivation'
851.      Journal:'J. Essent. Oil Res'      Year:'1995'      Volume:'7'      Page:'147'      DOI:'10.1080/10412905.1995.9698489'      Title:'Chemical Composition of Eucalyptus globulus Oils from the Montenegro Coast and East Coast of Spain'
871.      Journal:'Journal of Essential Oil Research'      Year:'1995'      Volume:'7'      Page:'265'      DOI:'10.1080/10412905.1995.9698517'      Title:'Comparison of the Volatile Flower Oils of Nicotiana rustica and N. forgetiana'
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