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ScientificNameLabel
Alpha-agarofuran
PHCD compound ID : 3132
Chemical Names :
Alpha-agarofuran
Molecular Formula : C15H24O1
Molecular Weight : 220.182715
More Details :
Names & Synonyms:
Smiles: CC1=CCC[C@@]2([C@@]31C[C@H](C(O3)(C)C)CC2)C
InChi : InChI=1S/C15H24O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h6,12H,5,7-10H2,1-4H3/t12-,14+,15+/m1/s1
InChi Key : InChIKey=ZLQADKTVJQXDIG-SNPRPXQTSA-N
PubChem ID : 10857022
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.128878
Hydrogen bond donor count : 0 Electric dipole moment : 1.450
XLogP : 3.168 VDW volume : 237.08062
Molecular weight : 220.182715 HOMO-LUMO gap : 10.385000
Herb list :
Refrences & Litretures:
  
426.      Journal:'Jordan Journal of Biological Sciences'      Year:'2015'      Volume:'8'      Page:'139'      DOI:''      Title:'The Chemical Composition and the Antibacterial Properties of Ruta graveolens L. Essential Oil Grown in Northern Jordan'
880.      Journal:'Phytother. Res'      Year:'2013'      Volume:'27'      Page:'1206'      DOI:'10.1002/ptr.4853'      Title:'Chemical composition and biological activities of polar extracts and essential oil of rose-scented geranium, Pelargonium graveolens'
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