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ScientificNameLabel
chrysanthenyl acetate
PHCD compound ID : 336
Chemical Names :
cis-Chrysanthenyl acetate , chrysanthenyl acetate
Molecular Formula : C12H18O2
Molecular Weight : 194.13068
More Details :
Names & Synonyms: [(1S,5R)-4,6,6-trimethyl-7-bicyclo[3.1.1]hept-3-enyl] acetate , acetic acid [(1S,5R)-4,6,6-trimethyl-7-bicyclo[3.1.1]hept-3-enyl] ester , [(1S,5R)-4,6,6-trimethyl-7-bicyclo[3.1.1]hept-3-enyl] ethanoate
Smiles: CC(=O)O[C@H]1[C@H]2CC=C([C@@H]1C2(C)C)C
InChi : InChI=1S/C12H18O2/c1-7-5-6-9-11(14-8(2)13)10(7)12(9,3)4/h5,9-11H,6H2,1-4H3/t9-,10+,11+/m1/s1
InChi Key : InChIKey=UASZOTVHPVEMQR-VWYCJHECSA-N
PubChem ID : 6431301
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.080052
Hydrogen bond donor count : 0 Electric dipole moment : 2.010
XLogP : 2.621 VDW volume : 203.702893
Molecular weight : 194.13068 HOMO-LUMO gap : 10.277000
Herb list :
Refrences & Litretures:
  
20.      Journal:'CHEMIJA'      Year:'2004'      Volume:'15'      Page:'64'      DOI:''      Title:'Chemical composition of essential oils of Artemisia absinthium L. (wormwood) growing wild in Vilnius'
49.      Journal:'Zahedan J Res Med Sci'      Year:'2013'      Volume:'15'      Page:'8'      DOI:''      Title:'Determining Chemical Composition and Antimicrobial Activity of Feverfew (Tanacetum parthenium L.) Essential Oil on Some Microbial Strains'
51.      Journal:'Int. J. Agric. Biol'      Year:'2010'      Volume:'12'      Page:'759'      DOI:''      Title:'Chemical Composition and Antimicrobial Activity of Feverfew (Tanacetum parthenium) Essential Oil'
52.      Journal:'Journal of Oleo Science'      Year:'2010'      Volume:'59'      Page:'177'      DOI:''      Title:'Antibacterial Activity and the Variation of Tanacetum parthenium (L.) Schultz Bip. Essential Oils from Turkey'
154.      Journal:'Flavour Fragr. J'      Year:'1997'      Volume:'12'      Page:'71'      DOI:''      Title:'Constituents of the Essential Oil of Achillea eriophora DC'
159.      Journal:'CHEMIJA'      Year:'2006'      Volume:'17'      Page:'12'      DOI:''      Title:'Chemical composition of essential oils of Artemisia vulgaris L. (mugwort) from North Lithuania'
178.      Journal:'Journal of Essential Oil Research'      Year:'2004'      Volume:'16'      Page:'262'      DOI:'10.1080/10412905.2004.9698716'      Title:'Comparative Investigation of the Essential Oils of Achillea talagonica Boiss. and A. millefolium, Chemical Composition and Immunological Studies'
181.      Journal:'Flavour Fragr. J'      Year:'2002'      Volume:'17'      Page:'165'      DOI:'10.1002/ffj.1074'      Title:'Essential oil composition of Achillea millefolium L. growing wild in Kashmir, India'
492.      Journal:'Herba Polonica'      Year:'2009'      Volume:'55'      Page:'53'      DOI:''      Title:'Volatile oil constituents of alecost [Tanacetum balsamita L. ssp. balsamitoides (Schultz-Bip.)] growing wild in North-West of Iran'
493.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2008'      Volume:'11'      Page:'476'      DOI:'10.1080/0972060X.2008.10643656'      Title:'Composition and Antimicrobial Activity of the Essential Oils of Tanacetum balsamita L. subsp. balsamita and T. chiliophyllum (Fisch. et Mey.) Schultz Bip. var. chiliophyllum (Asteraceae) from Turkey'
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'
675.      Journal:'Food Control'      Year:'2004'      Volume:'15'      Page:'549'      DOI:'10.1016/j.foodcont.2003.08.009'      Title:'Biological activities of the essential oils and methanol extract of Origanum vulgare ssp. vulgare in the Eastern Anatolia region of Turkey'
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