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ScientificNameLabel
epi-E-Caryophyllene-14-hydro-9
PHCD compound ID : 851
Chemical Names :
14-hydroxy-9-epi-E-Caryophyllene , 14-Hydroxy-9-EPI-(E)-Caryophyllene , epi-E-Caryophyllene-14-hydro-9
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms: [(4Z)-4,11-dimethyl-8-methylene-11-bicyclo[7.2.0]undec-4-enyl]methanol , [(4Z)-4,11-dimethyl-8-methylidene-11-bicyclo[7.2.0]undec-4-enyl]methanol
Smiles: OC[C@]1(C)C[C@H]2[C@H]1CCC(=CCCC2=C)C
InChi : InChI=1S/C15H24O/c1-11-5-4-6-12(2)13-9-15(3,10-16)14(13)8-7-11/h5,13-14,16H,2,4,6-10H2,1,3H3/b11-5-/t13-,14-,15+/m1/s1
InChi Key : InChIKey=DFMBJBXEHZSTJQ-KAIHXKKWSA-N
PubChem ID : 5352484
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.243171
Hydrogen bond donor count : 1 Electric dipole moment : 2.992
XLogP : 3.857 VDW volume : 246.80062
Molecular weight : 220.182715 HOMO-LUMO gap : 10.364000
Herb list :
Refrences & Litretures:
  
67.      Journal:'Innovative Food Science and Emerging Technologies'      Year:'2012'      Volume:'14'      Page:'85'      DOI:'10.1016/j.ifset.2012.01.002'      Title:'Comparison of ohmic-assisted hydrodistillation with traditional hydrodistillation for the extraction of essential oils from Thymus vulgaris L'
85.      Journal:'Food and Chemical Toxicology'      Year:'2010'      Volume:'48'      Page:'1562'      DOI:'10.1016/j.fct.2010.03.025'      Title:'Chemical composition of essential oils in Zataria multi?ora Boiss. From different parts of Iran and their radical scavenging and antimicrobial activity'
395.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2009'      Volume:'12'      Page:'111'      DOI:'10.1080/0972060X.2009.10643700'      Title:'Chemical Composition and Antimicrobial Activity of Essential Oil of Hyssopus angustifolius M.B'
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'
680.      Journal:'BIOLOGIJA'      Year:'2005'      Volume:'4'      Page:'53'      DOI:''      Title:'Chemical composition of essential oil and antimicrobial activity of Origanum vulgare'
972.      Journal:'Journal of Medicinal Plants Research'      Year:'2011'      Volume:'5'      Page:'6770'      DOI:'10.5897/JMPR11.1098'      Title:'Antibacterial and antimutagenic activity of extracts aboveground parts of three Solidago species: Solidago virgaurea L., Solidago canadensis L. and Solidago gigantea Ait'
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