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ScientificNameLabel
Geranic acid
PHCD compound ID : 847
Chemical Names :
Geranic acid
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms: (2E)-3,7-dimethylocta-2,6-dienoic acid
Smiles: CC(=CCC/C(=C/C(=O)O)/C)C
InChi : InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7+
InChi Key : InChIKey=ZHYZQXUYZJNEHD-VQHVLOKHSA-N
PubChem ID : 5275520
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.556356
Hydrogen bond donor count : 1 Electric dipole moment : 3.136
XLogP : 2.62 VDW volume : 191.187382
Molecular weight : 168.11503 HOMO-LUMO gap : 9.511000
Herb list :
Refrences & Litretures:
  
65.      Journal:'Middle-East J. Sci. Res'      Year:'2014'      Volume:'21'      Page:'1670'      DOI:''      Title:'Chemical Composition, Antioxidant and Antitumor Activity of Thymus vulgaris L. Essential Oil'
111.      Journal:'Pharmaceutical sciences'      Year:'2013'      Volume:'18'      Page:'187'      DOI:''      Title:'Chemical Composition and Antinociceptive Effect of the Essential Oil of Dracocephalum moldavica L'
371.      Journal:'Pharmaceutical Crops'      Year:'2011'      Volume:'2'      Page:'28'      DOI:''      Title:'Chemical composition and product quality control of turmeric (Curcuma longa L.)'
633.      Journal:'Journal of Biologically Active Products from Nature'      Year:'2011'      Volume:'1'      Page:'19'      DOI:'10.1080/22311866.2011.10719069'      Title:'Chemical Composition and Antimicrobial Activity of Rosa damascena Mill Essential Oil'
635.      Journal:'Analytica Chimica Acta'      Year:'2006'      Volume:'566'      Page:'172'      DOI:'10.1016/j.aca.2006.03.014'      Title:'Comparison of direct thermal desorption with water distillation and superheated water extraction for the analysis of volatile components of Rosa damascena Mill. using GCxGC-TOF/MS'
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