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ScientificNameLabel
Alpha-Isocomene
PHCD compound ID : 994
Chemical Names :
Alpha-Isocomene
Molecular Formula : C15H24
Molecular Weight : 204.187801
More Details :
Names & Synonyms:
Smiles: CC1=C[C@]2([C@@]3([C@@]1(C)CC[C@H]3C)CCC2)C
InChi : InChI=1S/C15H24/c1-11-6-9-14(4)12(2)10-13(3)7-5-8-15(11,13)14/h10-11H,5-9H2,1-4H3/t11-,13+,14+,15-/m1/s1
InChi Key : InChIKey=SAOJPWFHRMUCFN-UQOMUDLDSA-N
PubChem ID : 57501472
Rotatable bond count : 0 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.111120
Hydrogen bond donor count : 0 Electric dipole moment : 0.544
XLogP : 6.303 VDW volume : 228.290393
Molecular weight : 204.187801 HOMO-LUMO gap : 10.570000
Herb list :
Refrences & Litretures:
  
98.      Journal:'Chemistry of Natural Compounds'      Year:'2008'      Volume:'44'      Page:'800'      DOI:''      Title:'ESSENTIAL OIL COMPOSITION OF Tripleurospermum disciforme FROM IRAN'
101.      Journal:'Bull. Env. Pharmacol. Life Sci'      Year:'2014'      Volume:'3'      Page:'148'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Matricaria chamomilla'
104.      Journal:'Journal of Chromatography A'      Year:'2009'      Volume:'1216'      Page:'2768'      DOI:'10.1016/j.chroma.2008.09.109'      Title:'Fast gas chromatography characterisation of puri?ed semiochemicals from essential oils of Matricaria chamomilla L. (Asteraceae) and Nepeta cataria L. (Lamiaceae)'
252.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'39'      Page:'177'      DOI:'10.1016/j.indcrop.2012.02.030'      Title:'Rhizome and root yield of the cultivated Arnica montana L., chemical composition and histochemical localization of essential oil'
254.      Journal:'Journal of Essential Oil Research'      Year:'2011'      Volume:'23'      Page:'91'      DOI:'10.1080/10412905.2011.9700432'      Title:'Constituents of the Essential Oil from Hairy Roots and Plant Roots of Arnica montana L'
605.      Journal:'J Sci Food Agric'      Year:'2013'      Volume:'93'      Page:'2494'      DOI:'10.1002/jsfa.6065'      Title:'Chemical constituents and anti-ulcerogenic potential of the scales of Cynara scolymus (artichoke) heads'
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